The Ligandable Human Proteome

Carbonic anhydrase 2

Index	Ligand Name	Structure	PDB code	Compound Potency nM
1	sbr	Carbonic Anhydrase II Complexed With (R)-N-(3-Indol-1-yl-2-methyl-propyl)-4-sulfamoyl-benzamide	1if7	0.03
2	pof	Crystal structure of human carbonic anhydrase II in complex with STX237	3c7p	0.1
3	bzu	HUMAN CARBONIC ANHYDRASE II COMPLEXED WITH BRINZOLAMIDE	1a42	0.13
4	al3	CARBONIC ANHYDRASE II INHIBITOR	1bnu	0.2
5	sbs	Carbonic Anhydrase II Complexed With (S)-N-(3-Indol-1-yl-2-methyl-propyl)-4-sulfamoyl-benzamide	1if8	0.23
6	f2b	CARBONIC ANHYDRASE II COMPLEXED WITH 4-(AMINOSULFONYL)-N-[(2,3-DIFLUOROPHENYL)METHYL]-BENZAMIDE	1g52	0.29
7	al4	CARBONIC ANHYDRASE II INHIBITOR	1bnq	0.32
8	fsb	CARBONIC ANHYDRASE II COMPLEXED WITH 4-(AMINOSULFONYL)-N-[(2-FLUOROPHENYL)METHYL]-BENZAMIDE	1g1d	0.36
9	ets	THE POSITIONS OF HIS-64 AND A BOUND WATER IN HUMAN CARBONIC ANHYDRASE II UPON BINDING THREE STRUCTURALLY RELATED INHIBITORS	1cil	0.37
10	51j	Three dimensional structure of human carbonic anhydrase II in complex with 2-(But-2-yn-1-ylsulfamoyl)-4-sulfamoylbenzoic acid	5aml	0.7
11	f6b	CARBONIC ANHYDRASE II COMPLEXED WITH 4-(AMINOSULFONYL)-N-[(2,6-DIFLUOROPHENYL)METHYL]-BENZAMIDE	1g53	0.91
12	rz7	Fluoroalkyl and Alkyl Chains Have Similar Hydrophobicities in Binding to the Hydrophobic Wall of Carbonic Anhydrase	3rz7	1.1
13	5ef	Crystal structure of human carbonic anhydraseisozyme II with 3-[(1S)-2,3-Dihydro-1H-inden-1-ylamino]-2,5,6-trifluoro-4-[(2-hydroxyethyl)sulfonyl]benzenesulfonamide	5drs	1.1
14	inq	CARBONIC ANHYDRASE II COMPLEXED WITH AL-6619 2H-THIENO[3,2-E]-1,2-THIAZINE-6-SULFONAMIDE, 2-(3-HYDROXYPHENYL)-3-(4-MORPHOLINYL)-, 1,1-DIOXIDE	1i91	1.15
15	inl	CARBONIC ANHYDRASE II COMPLEXED WITH AL-6629 2H-THIENO[3,2-E]-1,2-THIAZINE-6-SULFONAMIDE, 2-(3-METHOXYPHENYL)-3-(4-MORPHOLINYL)-, 1,1-DIOXIDE	1i8z	1.27
16	inm	CARBONIC ANHYDRASE II COMPLEXED WITH AL-8520 2H-THIENO[3,2-E]-1,2-THIAZINE-6-SULFONAMIDE, 4-AMINO-3,4-DIHYDRO-2-(3-METHOXYPROPYL)-, 1,1-DIOXIDE, (R)	1i90	1.28
17	ffb	CARBONIC ANHYDRASE II COMPLEXED WITH 4-(AMINOSULFONYL)-N-[(2,3,4,5,6-PENTAFLUOROPHENYL)METHYL]-BENZAMIDE	1g54	1.5
18	pts	THE POSITIONS OF HIS-64 AND A BOUND WATER IN HUMAN CARBONIC ANHYDRASE II UPON BINDING THREE STRUCTURALLY RELATED INHIBITORS	1cim	1.52
19	f2b	CARBONIC ANHYDRASE II (F131V) COMPLEXED WITH 4-(AMINOSULFONYL)-N-[(2,3-DIFLUOROPHENYL)METHYL]-BENZAMIDE	1g46	1.6
20	rz1	Fluoroalkyl and Alkyl Chains Have Similar Hydrophobicities in Binding to the Hydrophobic Wall of Carbonic Anhydrase	3rz1	1.8
21	mts	THE POSITIONS OF HIS-64 AND A BOUND WATER IN HUMAN CARBONIC ANHYDRASE II UPON BINDING THREE STRUCTURALLY RELATED INHIBITORS	1cin	1.88
22	azm	H94N CARBONIC ANHYDRASE II COMPLEXED WITH ACETAZOLAMIDE	2h4n	2
23	ioa	CARBONIC ANHYDRASE II (F131V) COMPLEXED WITH 4-(AMINOSULFONYL)-N-[(2,5-DIFLUOROPHENYL)METHYL]-BENZAMIDE	1i9n	2.2
24	fsb	CARBONIC ANHYDRASE II (F131V) COMPLEXED WITH 4-(AMINOSULFONYL)-N-[(2-FLUOROPHENYL)METHYL]-BENZAMIDE	1g45	2.3
25	ryz	Fluoroalkyl and Alkyl Chains Have Similar Hydrophobicities in Binding to the Hydrophobic Wall of Carbonic Anhydrase	3ryz	2.4
26	d7a	Complex of human carbonic anhydrase II with N-[2-(3,4-dimethoxyphenyl)ethyl]-4-sulfamoylbenzamide	3v7x	2.7
27	45i	Three dimensional structure of human carbonic anhydrase II in complex with 2-((2-Phenylethyl)sulfamoyl)-4-sulfamoylbenzoic acid	5amd	2.8
28	bz1	Human Carbonic Anhydrase II in complex with Brinzolamide	4m2r	3.2
29	wwv	Crystal structure of human carbonic anhydrase II in complex with a benzenesulfonamide inhibitor	3n3j	3.3
30	8f2	Crystal structure of human carbonic anhydrase II in complex with (R)-4-(6,7-dihydroxy-1-phenyl-3,4-tetrahydroisoquinoline-1H-2-carbonyl)benzenesulfonamide.	5n0d	3.3
31	3cc	Crystal structure of the complex of hcaii with an indane-sulfonamide inhibitor	2qo8	3.4
32	8f3	Crystal structure of human carbonic anhydrase II in complex with (S)-4-(6,7-dihydroxy-1-phenyl-3,4-tetrahydroisoquinoline-1H-2-carbonyl)benzenesulfonamide.	5n0e	3.6
33	f6b	CARBONIC ANHYDRASE II (F131V) COMPLEXED WITH 4-(AMINOSULFONYL)-N-[(2,6-DIFLUOROPHENYL)METHYL]-BENZAMIDE	1g48	3.9
34	ioe	CARBONIC ANHYDRASE II (F131V) COMPLEXED WITH 4-(AMINOSULFONYL)-N-[(2,4,6-TRIFLUOROPHENYL)METHYL]-BENZAMIDE	1i9p	3.9
35	4kb	Carbonic anhydrase inhibitors: Design and synthesis of new heteroaryl-N-carbonylbenzenesulfonamides targeting druggable human carbonic anhydrase isoforms (hCA VII, hCA IX, and hCA XIV)	4z1k	4.7
36	azm	Use of Carbonic Anhydrase II, IX Active-Site Mimic, for the Purpose of Screening Inhibitors for Possible Anti-Cancer Properties	3dc3	4.9
37	fc4	Human carbonic anhydrase II in complex with ligand	5j8z	5
38	bsb	CARBONIC ANHYDRASE II (F131V) COMPLEXED WITH 4-(AMINOSULFONYL)-N-PHENYLMETHYLBENZAMIDE	1g4o	5.6
39	df5	Carbonic anhydrase inhibitors: Design and synthesis of new heteroaryl-N-carbonylbenzenesulfonamides targeting druggable human carbonic anhydrase isoforms (hCA VII, hCA IX, and hCA XIV)	4z1e	5.7
40	azm	STRUCTURAL BASIS OF INHIBITOR AFFINITY TO VARIANTS OF HUMAN CARBONIC ANHYDRASE II	1ydb	5.8
41	4kd	Carbonic anhydrase inhibitors: Design and synthesis of new heteroaryl-N-carbonylbenzenesulfonamides targeting druggable human carbonic anhydrase isoforms (hCA VII, hCA IX, and hCA XIV)	4z1n	5.89
42	rz8	Fluoroalkyl and Alkyl Chains Have Similar Hydrophobicities in Binding to the Hydrophobic Wall of Carbonic Anhydrase	3rz8	6.7
43	4k9	Carbonic anhydrase inhibitors: Design and synthesis of new heteroaryl-N-carbonylbenzenesulfonamides targeting druggable human carbonic anhydrase isoforms (hCA VII, hCA IX, and hCA XIV)	4z0q	6.8
44	ryx	Fluoroalkyl and Alkyl Chains Have Similar Hydrophobicities in Binding to the Hydrophobic Wall of Carbonic Anhydrase	3ryx	7.3
45	4kc	Carbonic anhydrase inhibitors: Design and synthesis of new heteroaryl-N-carbonylbenzenesulfonamides targeting druggable human carbonic anhydrase isoforms (hCA VII, hCA IX, and hCA XIV)	4z1j	7.7
46	0fz	Complex of human carbonic anhydrase II with 4-(6-methoxy-3,4-dihydroisoquinolin-1-yl)benzenesulfonamide	3vbd	8.6
47	oys	Human Carbonic Anhydrase II complexed with 2-{[4-AMINO-3-(3-HYDROXYPROP-1-YN-1-YL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-1-YL]METHYL}-5-METHYL-3-(2-METHYLPHENYL)QUINAZOLIN-4(3H)-ONE	3oys	9
48	ets	Carbonic Anhydrase II in complex with Dorzolamide	4m2u	9.1
49	2vq	The crystal structure of the human carbonic anhydrase II in complex with N-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl]sulfamide	4mo8	10.1
50	oy0	Human Carbonic Anhydrase II complexed with 1-(4-(4-(2-(ISOPROPYLSULFONYL)PHENYLAMINO)-1H-PYRROLO[2,3-B]PYRIDIN-6-YLAMINO)-3-METHOXYPHENYL)PIPERIDIN-4-OL	3oy0	10.1
51	oyq	Structure of Human Carbonic Anhydrase II complexed with 5,6-DIHYDRO-BENZO[H]CINNOLIN-3-YLAMINE	3oyq	10.3
52	arz	Crystal structure of human cabonic anhydrase II in adduct with an adamantyl analogue of acetazolamide in a novel hydrophobic binding pocket	3mhc	11
53	e1f	Crystal structure of human carbonic anhydrase isozyme II with 2-Chloro-4-[(pyrimidin-2-ylsulfanyl)acetyl]benzenesulfonamide	4knj	11.1
54	3bs	Crystal structure of the complex between Carbonic Anhydrase II and a spin-labeled sulfonamide incorporating TEMPO moiety	3eft	12
55	e90	Crystal structure of human carbonic anhydrase isozyme II with 4-[(2-pyrimidinylsulfanyl)acetyl]benzenesulfonamide	3sbi	12
56	azm	Neutron structure of acetazolamide-bound human carbonic anhydrase II reveal molecular details of drug binding.	4g0c	12
57	rz5	Fluoroalkyl and Alkyl Chains Have Similar Hydrophobicities in Binding to the Hydrophobic Wall of Carbonic Anhydrase	3rz5	13
58	2c7	Carbonic anhydrase inhibitors. Interaction of the antitumor sulfamate EMD-486019 with twelve mammalian isoforms: kinetic and X-Ray crystallographic studies	3dd8	14
59	8js	Synthesis of novel seleno ureido containing compounds as SLC-0111 analogs. Investigations on carbonic anhydrases activity, glutathione peroxidase and X-ray crystallography	5uln	14.2
60	bos	Crystal structure of the human carbonic anhydrase II in complex with a hypoxia-activatable sulfonamide.	2hd6	16
61	ryj	Carbonic Anhydrase complexed with 4-sulfamoyl-N-(2,2,2-trifluoroethyl)benzamide	3ryj	16
62	r21	Human carbonic anhydrase II in complex with 2-(3-chloro-4-hydroxyphenyl)-N-(4-sulfamoylphenethyl)acetamide	3nb5	18
63	e2i	Crystal structure of human carbonic anhydrase isozyme II with 4-{[(5-butyl-2-pyrimidinyl)sulfanyl]acetyl}benzenesulfonamide	3sap	26
64	rz0	Fluoroalkyl and Alkyl Chains Have Similar Hydrophobicities in Binding to the Hydrophobic Wall of Carbonic Anhydrase	3rz0	28
65	e27	Crystal structure of human carbonic anhydrase isozyme II with 2-chloro-5-[(1H-imidazo[4,5-c]quinolin-2-ylsulfanyl)acetyl]benzenesulfonamide	3myq	30
66	4wa	Human carbonic anhydrase II with an azobenzene inhibitor (1d)	5byi	30.7
67	5du	Crystal structure of human carbonic anhydrase isozyme II with 2-[(1S)-2,3-Dihydro-1H-inden-1-ylamino]-3,5,6-trifluoro-4-[(2-hydroxyethyl)thio]benzenesulfonamide	5doh	32
68	1vq	The crystal structure of the human carbonic anhydrase II in complex with a nitroimidazole sulfamate inhibitor	5o07	33.8
69	bz1	Genetically engineered Carbonic Anhydrase IX in complex with Brinzolamide	4m2v	36
70	d9h	Crystal structure of human carbonic anhydrase II in complex with a 1,3,5-triazine-substituted benzenesulfonamide inhibitor	3mmf	37
71	ryy	Fluoroalkyl and Alkyl Chains Have Similar Hydrophobicities in Binding to the Hydrophobic Wall of Carbonic Anhydrase	3ryy	38
72	po1	Crystal structure analysis of the human carbonic anhydrase II in complex with a 2-substituted estradiol bis-sulfamate	2gd8	39
73	dwh	The crystal structure of human carbonic anhydrase Ii in complex with a 1,3,5-triazine-substituted benzenesulfonamide inhibitor	3mna	41
74	eg2	SECONDARY INTERACTIONS SIGNIFICANTLY REMOVED FROM THE SULFONAMIDE BINDING POCKET OF CARBONIC ANHYDRASE II INFLUENCE BINDING CONSTANTS	1cnx	43
75	jdr	Crystal structure of human carbonic anhydrase isozyme II with 4-{[N-(6-chloro-5-formyl-2-methylthiopyrimidin-4-yl)amino]methyl}benzenesulfonamide	3m5e	43
76	cox	Carbonic anhydrase inhibitors: Valdecoxib binds to a different active site region of the human isoform II as compared to the structurally related cyclooxygenase II ""selective"" inhibitor Celecoxib	2aw1	43
77	e59	Crystal structure of human carbonic anhydrase isozyme II with 4-{[(4-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl)sulfanyl]acetyl}benzenesulfonamide	3s8x	50
78	p9b	Crystal structure of human carbonic anhydrase II in complex with a benzenesulfonamide inhibitor	3n0n	50
79	5un	Human CAII bound to N-(4-sulfamoylphenyl)-2-(thiophen-2-yl) acetamide	3r16	50
80	1go	structure of hCAII in complex with an acetazolamide derivative	4iwz	51
81	e65	Crystal structure of human carbonic anhydrase isozyme II with 4-{[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetyl}benzenesulfonamide	3sbh	52
82	ets	Genetically engineered Carbonic Anhydrase IX in complex with Dorzolamide	4m2w	52
83	j71	Crystal structure of human carbonic anhydrase isozyme II with 4-{[N-(6-methoxy-5-nitropyrimidin-4-yl)amino]methyl}benzenesulfonamide	3mhl	56
84	te1	Coumarins are a novel class of suicide carbonic anhydrase inhibitors	3f8e	59
85	i7c	The crystal structure of the human carbonic anhydrase II in complex with 4-amino-6-trifluoromethyl-benzene-1,3-disulfonamide	2pow	63
86	fun	carbonic anhydrase II in complex with furosemide as sulfonamide inhibitor	1z9y	65
87	8js	Discovery of new selenoureido analogs of 4-(4-fluorophenylureido) benzenesulfonamides as carbonic anhydrase inhibitors	5wex	66.3
88	i7b	The crystal structure of the human carbonic anhydrase II in complex with 4-amino-6-chloro-benzene-1,3-disulfonamide	2pov	75
89	ryv	Carbonic Anhydrase complexed with N-ethyl-4-sulfamoylbenzamide	3ryv	86
90	azm	STRUCTURAL BASIS OF INHIBITOR AFFINITY TO VARIANTS OF HUMAN CARBONIC ANHYDRASE II	1ydd	86
91	dt9	Crystal structure of human carbonic anhydrase II with 6,7-Dimethoxy-1-methyl-3,4-dihydroisoquinoline-2(1H)-sulfonamide	3po6	87.3
92	wwz	Crystal structure of human carbonic anhydrase II in complex with a benzenesulfonamide inhibitor	3n4b	96
93	j75	Crystal structure of human carbonic anhydrase isozyme II with 4-{[N-(6-benzylamino-5-nitropyrimidin-4-yl)amino]methyl}benzenesulfonamide	3mhm	100
94	js7	Crystal structure of human carbonic anhydrase isozyme II with 4-{2-[N-(6-methoxy-5-nitropyrimidin-4-yl)amino]ethyl}benzenesulfonamide	3m3x	150
95	e49	Crystal structure of human carbonic anhydrase isozyme II with 2-chloro-5-{[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetyl}benzenesulfonamide	3s9t	150
96	j45	Crystal structure of human carbonic anhydrase isozyme II with 4-[N-(6-chloro-5-nitropyrimidin-4-yl)amino]benzenesulfonamide	3m40	170
97	vz5	Human Carbonic anhydrase II bound by 2-Ethylestradiol 3-O-sulfamate	3oim	180
98	s6i	Human carbonic ahydrase II in complex with a benzenesulfonamide inhibitor	3mzc	226
99	wzb	Structures of human carbonic anhydrase II inhibitor complexes reveal a second binding site for steroidal and non-steroidal inhibitors.	2x7t	232
100	e50	Crystal structure of human carbonic anhydrase isozyme II with 2-chloro-5-{[(5-ethyl-2-pyrimidinyl)sulfanyl]acetyl}benzenesulfonamide	3sax	270
101	azm	STRUCTURAL BASIS OF INHIBITOR AFFINITY TO VARIANTS OF HUMAN CARBONIC ANHYDRASE II	1yda	280
102	j43	Crystal structure of human carbonic anhydrase isozyme II with 4-[N-(6-chloro-5-formyl-2-methylthiopyrimidin-4-yl)amino]benzenesulfonamide	3mho	320
103	vz4	Human Carbonic Anhydrase II in complex with 2-Ethylestrone-3-O-sulfamate	3oku	440
104	tg5	Human Carbonic Anhydrase II complexed with a two-faced guest	5ekm	480
105	vz4	Human Carbonic Anhydrase II A65S, N67Q (CA IX mimic) bound with 2-Ethylestrone 3-O-sulfamate	3okv	590
106	kr5	Crystal structure of human carbonic anhydrase isozyme II with 4-{[3-(3,5-Dimethyl-1H-pyrazol-1-yl)-3-oxopropyl]amino}benzene-1-sulfonamide	4q6e	667
107	wzb	Human Carbonic anhydrase II mutant A65S, N67Q (CA IX mimic) bound by 2-Ethylestradiol 3,17-O,O-bis-sulfamate	3oik	680
108	tg4	Human Carbonic Anhydrase II complexed with a two-faced guest	5ekj	1000
109	ctf	Crystal structure of the human carbonic anhydrase II in complex with STX 641 at 1.85 angstroms resolution	3bet	1500
110	wzc	Structures of human carbonic anhydrase II inhibitor complexes reveal a second binding site for steroidal and non-steroidal inhibitors.	2x7s	1660
111	vz5	Human Carbonic anhydrase II mutant A65S, N67Q (CA IX mimic) bound by 2-Ethylestradiol 3-O-sulfamate	3oil	2100
112	bl1	Carbonic anhydrase inhibitors. Sulfonamide diuretics revisited old leads for new applications	3bl1	2520
113	wza	Structures of human carbonic anhydrase II inhibitor complexes reveal a second binding site for steroidal and non-steroidal inhibitors.	2x7u	5340
114	pmx	Human carbonic anhydrase II in complex with (+)-Xylariamide A	3p4v	8000
115	azm	CARBONIC ANHYDRASE II MUTANT E117Q, TRANSITION STATE ANALOGUE ACETAZOLAMIDE	1zsb	2.5e+008