Index | Gene Name Primary | Protein Name | Uniprot ID | Gene Name Synonym | Ligand Name | Structure | PDB Code | ligand desolvation | Ligand Structure | Compound Affinity nM |
1 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | vc5 | Structure of molecular chaperone Grp94 bound to selective inhibitor methyl 2-[2-(2-benzylphenyl)ethyl]-3-chloro-4,6-dihydroxybenzoate | 6aom | 85.7 | | 630. |
2 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | vc1 | Structure of molecular chaperone Grp94 bound to selective inhibitor methyl 3-chloro-2-(2-{2-[(4-fluorophenyl)methyl]phenyl}ethyl)-4,6-dihydroxybenzoate | 6aol | 82.96 | | 540. |
3 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | gdm | GRP94 n-terminal domain bound to geldanamycin: effects of mutants 168-169 KS-AA | 2esa | 77.98 | | no data |
4 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | gdm | GRP94 N-terminal Domain bound to geldanamycin | 2exl | 79.99 | | no data |
5 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | cdy | Crystal Structure of the N-domain of the ER Hsp90 chaperone GRP94 in complex with 2-chlorodideoxyadenosine | 1qye | 88.52 | | no data |
6 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | rdc | N-Domain Of Grp94 Lacking The Charged Domain In Complex With Radicicol | 1u0z | 88.88 | | no data |
7 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | rda | GRP94 in complex with the novel HSP90 Inhibitor Radamide | 2gfd | 84.22 | | 520. |
8 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | rde | GRP94 in complex with the novel HSP90 Inhibitor Radester amine | 2fyp | 86.4 | | no data |
9 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | pa7 | N-Domain Of Grp94, with the Charged Domain, In Complex With the Novel Ligand N-Propyl Carboxyamido Adenosine | 6d1x | 79.45 | | no data |
10 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | pa7 | N-Domain Of Grp94 In Complex With the Novel Ligand N-Propyl Carboxyamido Adenosine | 2gqp | 84.11 | | no data |
11 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | nei | N-Domain Of Grp94 In Complex With the 2-Iodo-NECA | 2h8m | 91.2 | | no data |
12 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | p54 | Structure of the N-domain of GRP94 bound to the HSP90 inhibitor PU-H54 | 3o2f | 94.4 | | no data |
13 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | 2lc | Correlation between chemotype-dependent binding conformations of HSP90 alpha/beta and isoform selectivity | 4nh9 | 84.92 | | 375. |
14 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | 6c0 | Crystal structure of Grp94 bound to methyl 3-chloro-2-(2-(1-((5-chlorofuran-2-yl)methyl)-1H-imidazol-2-yl)ethyl)-4,6-dihydroxybenzoate, an inhibitor based on the BnIm and Radamide scaffolds. | 5in9 | 88.8 | | 440. |
15 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | 7ky | Crystal structure of Grp94 bound to isoform-selective inhibitor methyl 2-(2-(1-(4-bromobenzyl)-1H-imidazol-2-yl)ethyl)-3-chloro-4,6-dihydroxybenzoate | 5ttz | 74.1 | | no data |
16 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | 9qy | Structure of GRP94 N-terminal Domain bound to resorcinylic inhibitor BnIm. | 5wmt | 92.77 | | no data |
17 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | v2c | Structure of Grp94 with methyl 3-chloro-2-(2-(1-(2-ethoxybenzyl)-1 H-imidazol-2-yl)ethyl)-4,6-dihydroxybenzoate, a Grp94-selective inhibitor and promising therapeutic lead for treating myocilin-associated glaucoma | 6asp | 86.24 | | no data |
18 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | vc4 | Structure of Grp94 bound to methyl 2-[2-(2-benzylpyridin-3-yl)ethyl]-3-chloro-4,6-dihydroxybenzoate, a pan-Hsp90 inhibitor | 6asq | 86.68 | | no data |
19 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | d57 | Structure of GRP94 with a selective resorcinylic inhibitor. | 6baw | 90.05 | | no data |
20 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | eqd | Structure of GRP94 with a resorcinylic inhibitor. | 6c91 | 90.32 | | no data |
21 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | nec | Crystal Structure of the Unliganded Form of GRP94, the ER Hsp90: Basis for Nucleotide-Induced Conformational Change, GRP94N(DELTA)41 APO CRYSTAL SOAKED WITH NECA | 1ysz | 81.22 | | no data |
22 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | nec | Crystal Structure Of The N-Domain Of Grp94 Lacking The Charged Domain In Complex With Neca | 1u2o | 81.28 | | no data |
23 | ENPL | Endoplasmin | P14625 | GRP94 TRA1 | nec | Crystal Structure of the N-domain of the ER Hsp90 chaperone GRP94 in complex with the specific ligand NECA | 6d28 | 79.92 | | no data |
24 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | zz5 | Orally Active 2-Amino Thienopyrimidine Inhibitors of the Hsp90 Chaperone | 2wi5 | 89.85 | | 900. |
25 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | zz4 | Orally Active 2-Amino Thienopyrimidine Inhibitors of the Hsp90 Chaperone | 2wi4 | 79.46 | | 1560. |
26 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | yuk | Crystal structure of Hsp90-alpha N-terminal domain in complex with 2-(4-Hydroxy-cyclohexylamino)-4-[5-(4-phenyl-imidazol-1-yl)-isoquinolin-1-yl]-benzamide | 3wq9 | 89.03 | | no data |
27 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | xkl | structure of HSP90 with an inhibitor bound | 4bqj | 83.6 | | no data |
28 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | vj6 | Synthesis of Benzoquinone-Ansamycin-Inspired Macrocyclic Lactams from Shikimic Acid | 4jql | 81.57 | | 1000. |
29 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | vha | Hsp90 alpha N-terminal domain in complex with a macrocyclic inhibitor | 3vha | 78.17 | | 40. |
30 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | nec | Hsp90-alpha N-domain bound to NECA | 6b99 | 79.68 | | no data |
31 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | kfy | Hsp90-alpha S52A bound to PU-11-trans | 6olx | 82.77 | | no data |
32 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | kfy | Hsp90-alpha bound to PU-11-trans | 6n8x | 83.79 | | no data |
33 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | h71 | Structure of human Hsp90-alpha bound to the potent water soluble inhibitor PU-H71 | 2fwz | 80.45 | | 50. |
34 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | h0t | Hsp90 inhibitor desolvation as a rationale to steer on-rates and impact residence time | 5od7 | 81.81 | | no data |
35 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | gdm | GELDANAMYCIN BOUND TO THE HSP90 GELDANAMYCIN-BINDING DOMAIN | 1yet | 80.23 | | 1200. |
36 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | g5e | Hsp90 in complex with 5-(2,4-Dihydroxy-phenyl)-4-(2-fluoro-phenyl)-2,4-dihydro-[1,2,4]triazole-3-thione | 6hhr | 91.58 | | no data |
37 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | fu7 | Optimization of potent, selective, and orally bioavailable pyrrolodinopyrimidine-containing inhibitors of heat shock protein 90. identification of development candidate 2-amino-4-{4-chloro-2-[2-(4-fluoro-1H-pyrazol-1-yl)ethoxy]-6-methylphenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide | 3r4p | 82.89 | | 11. |
38 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | fu3 | Optimization of Potent, Selective, and Orally Bioavailable Pyrrolodinopyrimidine-containing Inhibitors of Heat Shock Protein 90. Identification of Development Candidate 2-amino-4-{4-chloro-2-[2-(4-fluoro-1H-pyrazol-1-yl)ethoxy]-6-methylphenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide | 3r4o | 82.52 | | 7. |
39 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | fjs | Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FJ6 | 5cf0 | 82.82 | | no data |
40 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | dz8 | Structure of human Hsp90-alpha bound to the potent water soluble inhibitor PU-DZ8 | 2h55 | 80.87 | | no data |
41 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | c8w | Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation | 6f1n | 82.93 | | no data |
42 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | c4n | Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation | 6ey9 | 84.75 | | no data |
43 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 9zc | Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FS7 | 5xrd | 82.71 | | no data |
44 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 9un | Structure of HSP90 with NMS-E973 inhibitor bound | 4b7p | 77.58 | | 0.346 |
45 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 99b | Complex of HSP90 ATPase domain with tropane derived inhibitors | 4awo | 90.05 | | 24. |
46 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 99a | Complex of HSP90 ATPase domain with tropane derived inhibitors | 4awp | 84.28 | | 81. |
47 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 72k | CRYSTAL STRUCTURE OF HSP90 IN COMPLEX WITH SAR200323. | 5lq9 | 86.66 | | no data |
48 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 70o | HSP90 WITH indazole derivative | 5lo6 | 81.8 | | no data |
49 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 70n | HSP90 WITH indazole derivative | 5lo0 | 83.26 | | no data |
50 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 4eq | Heat Shock Protein 90 Bound to CS307 | 4ykt | 67.4 | | no data |
51 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2r6 | Identification of novel HSP90 / isoform selective inhibitors using structure-based drug design. Demonstration of potential utility in treating CNS disorders such as Huntington s disease | 4o09 | 91.15 | | 20. |
52 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2qa | Identification of novel HSP90/isoform selective inhibitors using structure-based drug design. Demonstration of potential utility in treating CNS disorders such as Huntington's disease | 4o0b | 91.63 | | 5. |
53 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2kl | Orally Active 2-Amino Thienopyrimidine Inhibitors of the Hsp90 Chaperone | 2wi7 | 75.26 | | 58. |
54 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2dd | 3-(5-chloro-2,4-dihydroxyphenyl)-pyrazole-4-carboxamides as Inhibitors of the Hsp90 Molecular Chaperone | 2byi | 89.13 | | 461. |
55 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | rdc | Human Hsp90-alpha ATPase domain bound to Radicicol | 4egk | 87.93 | | 19. |
56 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu4 | Human Hsp90-alpha with 9-Butyl-8-(4-methoxy-benzyl)-9H-purin-6-ylamine | 1uy7 | 80.11 | | 200000. |
57 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu5 | Human Hsp90-alpha with 9-Butyl-8-(3-trimethoxy-benzyl)-9H-purin-6ylamine | 1uy8 | 82.05 | | 75000. |
58 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu6 | Human Hsp90-alpha with 8-Benzo[1,3]dioxol-,5-ylmethyl-9-butyl-9H-purin-6-ylamine | 1uy9 | 80.63 | | 15300. |
59 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu7 | Human Hsp90-alpha with 9-Butyl-8-(2,5-dimethoxy-benzyl)-9H-purin-6-ylamine | 1uyc | 82.89 | | 41000. |
60 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu8 | Human Hsp90-alpha with 9-Butyl-8-(2-chloro-3,4,5-trimethoxy-benzyl)-9H-purin-6-ylamine | 1uyd | 85.54 | | 200000. |
61 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu9 | Human Hsp90-alpha with 8-(2-chloro-3,4,5-trimethoxy-benzyl)-9-pent-4-ylnyl-9H-purin-6-ylamine | 1uye | 86.18 | | 200000. |
62 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu1 | Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation | 6el5 | 86.61 | | no data |
63 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu1 | Human Hsp90-alpha with 8-(2-chloro-3,4,5-trimethoxy-benzyl)-2-fluoro-9-pent-4-ylnyl-9H-purin-6-ylamine | 1uyf | 85.36 | | 30000. |
64 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu2 | Human Hsp90-alpha with 8-(2,5-dimethoxy-benzyl)-2-fluoro-9H-purin-6-ylamine | 1uyg | 88.37 | | 53500. |
65 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu0 | Human Hsp90-alpha with 9-Butyl-8-(2,5-dimethoxy-benzyl)-2-fluoro-9H-purin-6-ylamine | 1uyh | 82.71 | | 14300. |
66 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | puz | Human Hsp90-alpha with 8-(2,5-dimethoxy-benzyl)-2-fluoro-9-pent-9H-purin-6-ylamine | 1uyi | 85.44 | | 4100. |
67 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pux | Human Hsp90-alpha with 8-Benzo[1,3]dioxol-,5-ylmethyl-9-butyl-2-fluoro-9H-purin-6-ylamine | 1uyk | 82.12 | | 17100. |
68 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pu3 | Human Hsp90-alpha with 9-Butyl-8-(3,4,5-trimethoxy-benzyl)-9H-purin-6-ylamine | 1uy6 | 80.12 | | 200000. |
69 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 4bc | Crystal Structures of human HSP90alpha complexed with dihydroxyphenylpyrazoles | 1yc1 | 83.26 | | 680. |
70 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 4bc | Crystal Structure of human HSP90alpha complexed with dihydroxyphenylpyrazoles | 1yc3 | 81.85 | | no data |
71 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | ct5 | Novel, potent small molecule inhibitors of the molecular chaperone Hsp90 discovered through structure-based design | 2bt0 | 88.83 | | no data |
72 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2d7 | 3-(5-chloro-2,4-dihydroxyphenyl)-pyrazole-4-carboxamides as Inhibitors of the Hsp90 Molecular Chaperone | 2byh | 87.75 | | 258. |
73 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 4bh | HUMAN HSP90 WITH 4-CHLORO-6-(4-PIPERAZIN-1-YL-1H-PYRAZOL-3-YL)- BENZENE-1,2-DIOL | 2ccs | 92.33 | | 2000. |
74 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2e1 | HUMAN HSP90 WITH 5-(5-CHLORO-2,4-DIHYDROXY-PHENYL)-4-PIPERAZIN-1-YL- 2H-PYRAZOLE-3-CARBOXYLIC ACID ETHYLAMIDE | 2cct | 89.58 | | 9500. |
75 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2d9 | HUMAN HSP90 WITH 4-CHLORO-6-(4-(4-(4-METHANESULPHONYL-BENZYL)- PIERAZIN-1-YL)-1H-PYRAZOL-3-YL)-BENZENE-1,3-DIOL | 2ccu | 77.8 | | 740. |
76 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | h64 | Structure of human Hsp90-alpha bound to the potent water soluble inhibitor PU-H64 | 2fwy | 76.99 | | 200. |
77 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | a94 | HSP90 complexed with A943037 | 2qg0 | 83.9 | | 1900. |
78 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | a91 | HSP90 complexed with A917985 | 2qg2 | 86.82 | | 4000. |
79 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2gg | Inhibition of the HSP90 molecular chaperone in vitro and in vivo by novel, synthetic, potent resorcinylic pyrazole, isoxazole amide analogs | 2uwd | 87.12 | | 4.5 |
80 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2gj | 4,5 Diaryl Isoxazole Hsp90 Chaperone Inhibitors: Potential Therapeutic Agents for the Treatment of Cancer | 2vci | 82.9 | | 21. |
81 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2eq | 4,5 Diaryl Isoxazole Hsp90 Chaperone Inhibitors: Potential Therapeutic Agents for the Treatment of Cancer | 2vcj | 80.49 | | 21. |
82 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | zz6 | Orally Active 2-Amino Thienopyrimidine Inhibitors of the Hsp90 Chaperone | 2wi6 | 84.43 | | 230. |
83 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | vhd | Structure of HSP90 with an inhibitor bound | 2xab | 82.85 | | 0.54 |
84 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2dl | Structure of HSP90 with small molecule inhibitor bound | 2xdl | 92.17 | | 790000. |
85 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | c0p | Structure of HSP90 with small molecule inhibitor bound | 2xhr | 81.43 | | 4.8 |
86 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | c0y | Structure of HSP90 with small molecule inhibitor bound | 2xht | 89.8 | | 1100. |
87 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | t5m | Structure of HSP90 with small molecule inhibitor bound | 2xhx | 82.51 | | 250. |
88 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | xjg | Structure of HSP90 with small molecule inhibitor bound | 2xjg | 81.2 | | 15. |
89 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | xjx | Structure of HSP90 with small molecule inhibitor bound | 2xjx | 65.23 | | 0.71 |
90 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | yjw | Tricyclic series of Hsp90 inhibitors | 2yk2 | 86.64 | | no data |
91 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | yjw | Tricyclic series of Hsp90 inhibitors | 2yjw | 90.36 | | 7600. |
92 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | ykb | Tricyclic series of Hsp90 inhibitors | 2ykb | 92.57 | | 1100. |
93 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | yke | Tricyclic series of Hsp90 inhibitors | 2yke | 90.34 | | 1100. |
94 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | p4a | Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation | 6eln | 92.52 | | no data |
95 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | cxz | Discovery of Benzisoxazoles as Potent Inhibitors of Chaperone Hsp90 | 3bmy | 83.16 | | 30. |
96 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | snx | Crystal Structure of Benzamide Tetrahydro-4H-carbazol-4-one bound to Hsp90 | 3d0b | 87.15 | | 290. |
97 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | py9 | Dihydroxylphenyl amides as inhibitors of the Hsp90 molecular chaperone | 3ekr | 86.31 | | 30. |
98 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | moj | Structure of HSP90 bound with a noval fragment. | 3ft8 | 87.91 | | 30. |
99 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | bd0 | HSP90 N-terminal domain in complex with 1-{4-[(2R)-1-(5-chloro-2,4-dihydroxybenzoyl)pyrrolidin-2-yl]benzyl}-3,3-difluoropyrrolidinium | 3hek | 86.04 | | 5.4 |
100 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 819 | Human heat-shock protein 90 (HSP90) in complex with {4-[3-(2,4-dihydroxy-5-isopropyl-phenyl)-5-thioxo- 1,5-dihydro-[1,2,4]triazol-4-yl]-benzyl}-carbamic acid ethyl ester {ZK 2819} | 3hhu | 83.63 | | 41. |
101 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | z64 | Crystal structure of Hsp90 with fragment Z064 | 3hz5 | 86.89 | | no data |
102 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | jzb | HSP90 N-TERMINAL DOMAIN with pochoxime A | 3inw | 89.04 | | no data |
103 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | jzc | HSP90 N-TERMINAL DOMAIN with pochoxime B | 3inx | 89.04 | | no data |
104 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 4cd | HSP90 N-terminal domain in complex with 4-chloro-6-{[(2R)-2-(2-methylphenyl)pyrrolidin-1-yl]carbonyl}benzene-1,3-diol | 3k97 | 84.62 | | 10. |
105 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 1rc | HSP90 N-terminal domain in complex with (1R)-2-(5-chloro-2,4-dihydroxybenzoyl)-N-ethylisoindoline-1-carboxamide | 3k98 | 81.16 | | 1. |
106 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | pft | HSP90 N-terminal domain in complex with 4-(1,3-dihydro-2H-isoindol-2-ylcarbonyl)benzene-1,3-diol | 3k99 | 87.23 | | 60. |
107 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | sd1 | Crystal Structure of Benzamide SNX-1321 bound to Hsp90 | 3mnr | 85.19 | | no data |
108 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | p54 | Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor PU-H54 | 3o0i | 85.86 | | no data |
109 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | bsm | Novel, potent small molecule inhibitors of the molecular chaperone Hsp90 discovered through structure-based design | 2bsm | 86.65 | | no data |
110 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | bsm | Crystal Structure of HSP90 with VER-49009 | 3owb | 87.16 | | 19. |
111 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 94m | HSP90A N-terminal domain in complex with BIIB021 | 3qdd | 88.07 | | 1.7 |
112 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 05s | Design and SAR of macrocyclic Hsp90 inhibitors with increased metabolic stability and potent cell-proliferation activity | 3qtf | 87.14 | | 110. |
113 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | fu5 | Optimization of Potent, Selective, and Orally Bioavailable Pyrrolodinopyrimidine-containing Inhibitors of Heat Shock Protein 90. Identification of Development Candidate 2-amino-4-{4-chloro-2-[2-(4-fluoro-1H-pyrazol-1-yl)ethoxy]-6-methylphenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide | 3r4n | 79.02 | | 130. |
114 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 06h | Macrocyclic lactams as potent Hsp90 inhibitors with excellent tumor exposure and extended biomarker activity. | 3r91 | 90.26 | | 92. |
115 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 06t | Discovery of a stable macrocyclic o-aminobenzamide Hsp90 inhibitor capable of significantly decreasing tumor volume in a mouse xenograft model. | 3rkz | 83.25 | | 83. |
116 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | vhc | Hsp90 alpha N-terminal domain in complex with a macrocyclic inhibitor | 3vhc | 80.62 | | 1.3 |
117 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | vhe | Hsp90 alpha N-terminal domain in complex with a macrocyclic inhibitor, CH5164840 | 3vhd | 80.19 | | 0.52 |
118 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | wha | Hsp90 alpha N-terminal domain in complex with a tricyclic inhibitor | 3wha | 83.49 | | 0.48 |
119 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 592 | Complex of HSP90 ATPase domain with tropane derived inhibitors | 4awq | 83.06 | | 479. |
120 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | h05 | Human HSP90 alpha N-terminal domain in complex with an Aminotriazoloquinazoline inhibitor | 4cwf | 82.96 | | 32400. |
121 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 6lv | Human HSP90 alpha N-terminal domain in complex with an Aminotriazoloquinazoline inhibitor | 4cwn | 86.42 | | 2600. |
122 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | t62 | Human HSP90 alpha N-terminal domain in complex with an Aminotriazoloquinazoline inhibitor | 4cwo | 89.36 | | 6100. |
123 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | tv2 | Human HSP90 alpha N-terminal domain in complex with an Aminotriazoloquinazoline inhibitor | 4cwp | 85.12 | | 170. |
124 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | haj | Human HSP90 alpha N-terminal domain in complex with an Aminotriazoloquinazoline inhibitor | 4cwr | 85.55 | | 5. |
125 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | g3r | Human HSP90 alpha N-terminal domain in complex with an Aminotriazoloquinazoline inhibitor | 4cws | 83.47 | | 12. |
126 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | ik9 | Human HSP90 alpha N-terminal domain in complex with an Aminotriazoloquinazoline inhibitor | 4cwt | 81.97 | | 179. |
127 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | efu | Hsp90 Alpha N-terminal Domain in Complex with an Inhibitor 6-Hydroxy-3-(3-methyl-benzyl)-1H-indazole-5-carboxylic acid benzyl-methyl-amide | 4efu | 89.28 | | 250. |
128 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | rl1 | Crystal structure of Human Hsp90 with RL1 | 4l8z | 84.73 | | no data |
129 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | rl3 | Crystal structure of Human Hsp90 with RL3 | 4l90 | 84.3 | | no data |
130 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | s36 | Crystal structure of Human Hsp90 with S36 | 4l93 | 79.61 | | no data |
131 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | s46 | Crystal structure of Human Hsp90 with S46 | 4l94 | 84.48 | | no data |
132 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | fj2 | Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FJ2 | 4lwe | 80.69 | | 70. |
133 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | fj4 | Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FJ4 | 4lwg | 81.22 | | no data |
134 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | fj5 | Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FJ5 | 4lwh | 79.07 | | 27. |
135 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | fj6 | Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FJ6 | 4lwi | 85.15 | | 23. |
136 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | e0g | Correlation between chemotype-dependent binding conformations of HSP90 alpha/beta and isoform selectivity | 4nh7 | 96.16 | | 4. |
137 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2lc | Correlation between chemotype-dependent binding conformations of HSP90 alpha/beta and isoform selectivity | 4nh8 | 90.69 | | 3. |
138 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2q8 | Identification of novel HSP90/isoform selective inhibitors using structure-based drug design. Demonstration of potential utility in treating CNS disorders such as Huntington's disease | 4o04 | 87.49 | | 690. |
139 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 2q9 | Identification of novel HSP90/isoform selective inhibitors using structure-based drug design. Demonstration of potential utility in treating CNS disorders such as Huntington's disease | 4o05 | 89.25 | | 37. |
140 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | fgh | Identification of novel HSP90/isoform selective inhibitors using structure-based drug design. Demonstration of potential utility in treating CNS disorders such as Huntington's disease | 4o07 | 89.69 | | 42. |
141 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | jr9 | Crystal structure of Human Hsp90 with JR9 | 4r3m | 84.56 | | no data |
142 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 990 | Crystal Structure of Hsp90-alpha N-domain Bound to the Inhibitor NVP-HSP990 | 4u93 | 88.07 | | 13. |
143 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 3jc | Crystal Structure of Hsp90-alpha N-domain Bound to the Inhibitor NVP-HSP990 | 4w7t | 82.56 | | 900. |
144 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 40w | Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock protein 90 inhibitors | 4xip | 92.44 | | 235. |
145 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 40y | Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock protein 90 inhibitors | 4xiq | 92.58 | | 86. |
146 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 40x | Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock protein 90 inhibitors | 4xir | 89.37 | | 115. |
147 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 40z | Discovery of novel oxazepine and diazepine carboxamides as two new classes of heat shock protein 90 inhibitors | 4xit | 85.61 | | 54. |
148 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 4et | Heat Shock Protein 90 Bound to CS318 | 4ykx | 88.37 | | no data |
149 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 4ev | Heat Shock Protein 90 Bound to CS320 | 4ykz | 85.58 | | no data |
150 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | tql | Dynamic Undocking and the Quasi-Bound State as tools for Drug Design | 5fnf | 81.61 | | 700000. |
151 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 7ft | Hsp90 alpha N-terminal domain in complex with an inhibitor | 5h22 | 83.24 | | no data |
152 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 6g7 | Crystal Structure of Hsp90-alpha N-domain in complex with 5-(2,4-Dihydroxy-phenyl)-4-(2-fluoro-phenyl)-2,4-dihydro-[1,2,4]triazol-3-one | 5j64 | 91.66 | | no data |
153 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 6gc | HSP90 in complex with N-Butyl-5-[4-(2-fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-2,4-dihydroxy-N-methyl-benzamide | 5j9x | 88 | | no data |
154 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 6gc | Crystal Structure of Hsp90-alpha N-domain in complex with N-Butyl-5-[4-(2-fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-2,4-dihydroxy-N-methyl-benzamide | 5j6l | 89.07 | | no data |
155 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 6fj | HSP90 in complex with 5-[4-(2-Fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-N-furan-2-ylmethyl-2,4-dihydroxy-N-methyl-benzamide | 5j20 | 87.3 | | no data |
156 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 6fj | Crystal Structure of Hsp90-alpha N-domain L107 mutant in complex with 5-[4-(2-Fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-N-furan-2-ylmethyl-2,4-dihydroxy-N-methyl-benzamide | 5j6m | 87.54 | | no data |
157 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 6ff | HSP90 in complex with 5-[4-(2-Fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-2,4-dihydroxy-N-methyl-N-propyl-benzenesulfonamide | 5j27 | 86.68 | | no data |
158 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 6ff | Crystal Structure of Hsp90-alpha N-domain L107A mutant in complex with 5-[4-(2-Fluoro-phenyl)-5-oxo-4,5-dihydro-1H-[1,2,4]triazol-3-yl]-2,4-dihydroxy-N-methyl-N-propyl-benzenesulfonamide | 5j6n | 87.06 | | no data |
159 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 6gw | Crystal Structure of Hsp90-alpha N-domain in complex with 2,4-Dihydroxy-N-methyl-5-(5-oxo-4-o-tolyl-4,5-dihydro-1H-[1,2,4]triazol-3-yl)-N-thiophen-2-ylmethyl-benzamide | 5j86 | 91.25 | | no data |
160 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 70k | HSP90 WITH indazole derivative | 5lny | 81.3 | | no data |
161 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 70z | HSP90 WITH indazole derivative | 5lnz | 82.25 | | no data |
162 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 70l | HSP90 WITH indazole derivative | 5lo1 | 84.32 | | no data |
163 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 70m | HSP90 WITH indole derivative | 5lo5 | 92.28 | | no data |
164 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 72y | CRYSTAL STRUCTURE OF HSP90 IN COMPLEX WITH A003498614A. | 5lr1 | 87.46 | | no data |
165 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 73s | CRYSTAL STRUCTURE OF HSP90 IN COMPLEX WITH A003492875 | 5lrl | 89.17 | | no data |
166 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 73z | CRYSTAL STRUCTURE OF HSP90 IN COMPLEX WITH SAR166475 | 5ls1 | 87.23 | | no data |
167 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 7f9 | Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase | 5m4e | 87.31 | | no data |
168 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 7fx | Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase | 5m4h | 89.38 | | no data |
169 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 9ek | Crystal Structure of Hsp90-alpha N-Domain in complex with Indazole derivative | 5nyh | 80.72 | | no data |
170 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 9r8 | Human Heat Shock Protein 90 bound to 6-Hydroxy-3-(3-methyl-benzyl)-1H-indazole-5-carboxylic acid methyl-(4-morpholin-4-yl-phenyl)-amide | 5oci | 81.7 | | no data |
171 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 9rz | Crystal Structure of Hsp90-alpha N-Domain in complex with Indazole derivative | 5odx | 87.39 | | no data |
172 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 74e | CRYSTAL STRUCTURE OF HSP90 IN COMPLEX WITH SAR148019. | 5t21 | 87.13 | | no data |
173 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 9qy | Structure of human Hsp90-alpha bound to resorcinylic inhibitor BnIm | 5vyy | 86.47 | | no data |
174 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 8cf | Crystal structure of Human Hsp90 with FS2 | 5xqd | 85.48 | | no data |
175 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 8co | Crystal structure of Human Hsp90 with FS3 | 5xqe | 77.57 | | no data |
176 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 8cr | Crystal structure of Human Hsp90 with FS4 | 5xr5 | 80.29 | | no data |
177 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 8cu | Crystal structure of Human Hsp90 with FS6 | 5xr9 | 80.53 | | no data |
178 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 8du | Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor FJ5 | 5xrb | 80.06 | | no data |
179 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | jx1 | Crystal Structure of the human Hsp90-alpha N-domain bound to the hsp90 inhibitor JX1 | 5xre | 83.07 | | no data |
180 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | d57 | Structure of Hsp90 NTD with a GRP94-selective resorcinylic inhibitor. | 6ceo | 87.76 | | no data |
181 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | b5q | Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation | 6ei5 | 79.82 | | no data |
182 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | baw | Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation | 6elo | 91.23 | | no data |
183 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | ba8 | Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation | 6elp | 83.65 | | no data |
184 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | c4t | Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation | 6ey8 | 89.86 | | no data |
185 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | c4k | Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation | 6eya | 89.11 | | no data |
186 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | c3z | Estimation of relative drug-target residence times by random acceleration molecular dynamics simulation | 6eyb | 87.37 | | no data |
187 | HS90A | Heat shock protein HSP 90-alpha | P07900 | HSP90A HSPC1 HSPCA | 4eu | Heat Shock Protein 90 Bound to CS319 | 4yky | 87.06 | | no data |
188 | HS90B | Heat shock protein HSP 90-beta | P08238 | HSP90B HSPC2 HSPCB | kfy | Hsp90-beta bound to PU-11-trans | 6n8y | 82.67 | | no data |
189 | HS90B | Heat shock protein HSP 90-beta | P08238 | HSP90B HSPC2 HSPCB | pu3 | Human Hsp90-beta with PU3 (9-Butyl-8(3,4,5-trimethoxy-benzyl)-9H-purin-6-ylamine) | 1uym | 84.39 | | 1000. |
190 | HS90B | Heat shock protein HSP 90-beta | P08238 | HSP90B HSPC2 HSPCB | 7pp | Hsp90b N-terminal domain in complex with EC44, a pyrrolo-pyrimidine methoxypyridine inhibitor | 3nmq | 79.09 | | 0.2 |
191 | HS90B | Heat shock protein HSP 90-beta | P08238 | HSP90B HSPC2 HSPCB | 83s | Hsp90b N-terminal domain with inhibitors | 5uc4 | 82.32 | | no data |
192 | HS90B | Heat shock protein HSP 90-beta | P08238 | HSP90B HSPC2 HSPCB | 871 | Hsp90b N-terminal domain with inhibitors | 5uch | 83.98 | | no data |
193 | HS90B | Heat shock protein HSP 90-beta | P08238 | HSP90B HSPC2 HSPCB | 874 | Hsp90b N-terminal domain with inhibitors | 5uci | 85.25 | | no data |
194 | HS90B | Heat shock protein HSP 90-beta | P08238 | HSP90B HSPC2 HSPCB | ku3 | Hsp90b N-terminal domain with inhibitors | 5ucj | 83.94 | | no data |
195 | PDK2 | [Pyruvate dehydrogenase | Q15119 | PDHK2 | sz6 | VER-246608, a novel pan-isoform ATP competitive inhibitor of pyruvate dehydrogenase kinase, disrupts Warburg metabolism and induces context- dependent cytostasis in cancer cells | 4v25 | 72.03 | | 84. |
196 | PDK2 | [Pyruvate dehydrogenase | Q15119 | PDHK2 | 7tj | VER-246608, a novel pan-isoform ATP competitive inhibitor of pyruvate dehydrogenase kinase, disrupts Warburg metabolism and induces context- dependent cytostasis in cancer cells | 4v26 | 71.64 | | no data |
197 | PDK2 | [Pyruvate dehydrogenase | Q15119 | PDHK2 | 7fw | Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase | 5m4m | 77.99 | | no data |
198 | PDK2 | [Pyruvate dehydrogenase | Q15119 | PDHK2 | 7fv | Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase | 5m4n | 63.78 | | no data |
199 | PDK2 | [Pyruvate dehydrogenase | Q15119 | PDHK2 | 7fe | Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase | 5m4p | 73.51 | | no data |
200 | PDK2 | [Pyruvate dehydrogenase | Q15119 | PDHK2 | pft | Crystal structure of pyruvate dehydrogenase kinase isoform 2 in complex with inhibitor PA7 | 4mp7 | 83.05 | | 1827. |
201 | PDK2 | [Pyruvate dehydrogenase | Q15119 | PDHK2 | pv1 | Crystal structure of pyruvate dehydrogenase kinase isoform 2 in complex with inhibitor PA1 | 4mp2 | 81.26 | | 3570. |
202 | PDK2 | [Pyruvate dehydrogenase | Q15119 | PDHK2 | p35 | Crystal structure of pyruvate dehydrogenase kinase isoform 2 in complex with inhibitor PS35 | 5j71 | 73.89 | | 110. |
203 | PDK2 | [Pyruvate dehydrogenase | Q15119 | PDHK2 | 7f9 | Application of Off-Rate Screening in the Identification of Novel Pan-Isoform Inhibitors of Pyruvate Dehydrogenase Kinase | 5m4k | 75.88 | | 2170. |
204 | PDK3 | [Pyruvate dehydrogenase | Q15120 | PDHK3 | rdc | Pyruvate dehydrogenase kinase isoform 3 in complex with antitumor drug radicicol | 2q8i | 79.31 | | 400000. |
205 | PDK4 | [Pyruvate dehydrogenase | Q16654 | PDHK4 | p4a | Inhibitor-bound structures of human pyruvate dehydrogenase kinase 4 | 2zdx | 77.8 | | 648000. |