Compile Data Set for Download or QSAR

Found 26 hits Enz. Inhib. hit(s) with all data for entry = 50005624   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038950 (CHEMBL303188 | [2-(4-Sulfamoyl-benzoylamino)-acety...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCC(=O)NCC(=O)OCc1ccccc1 Show InChI InChI=1S/C18H19N3O6S/c19-28(25,26)15-8-6-14(7-9-15)18(24)21-10-16(22)20-11-17(23)27-12-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,20,22)(H,21,24)(H2,19,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	71	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM10880 (AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...) Show SMILES CC(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB PubMed	n/a	n/a	n/a	6.80	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038953 (CHEMBL67475 | N-Pyridin-4-ylmethyl-4-sulfamoyl-ben...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1ccncc1 Show InChI InChI=1S/C13H13N3O3S/c14-20(18,19)12-3-1-11(2-4-12)13(17)16-9-10-5-7-15-8-6-10/h1-8H,9H2,(H,16,17)(H2,14,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038952 (4-Sulfamoyl-benzamide | CHEMBL67797) Show SMILES NC(=O)c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C7H8N2O3S/c8-7(10)5-1-3-6(4-2-5)13(9,11)12/h1-4H,(H2,8,10)(H2,9,11,12)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038954 (CHEMBL67854 | {2-[(R)-3-Phenyl-2-(4-sulfamoyl-benz...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)OCc1ccccc1 Show InChI InChI=1S/C27H28N4O7S/c28-39(36,37)22-13-11-21(12-14-22)26(34)31-23(15-19-7-3-1-4-8-19)27(35)30-16-24(32)29-17-25(33)38-18-20-9-5-2-6-10-20/h1-14,23H,15-18H2,(H,29,32)(H,30,35)(H,31,34)(H2,28,36,37)/t23-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038955 (CHEMBL65268 | N-(2-Methyl-benzyl)-4-sulfamoyl-benz...) Show SMILES Cc1ccccc1CNC(=O)c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H16N2O3S/c1-11-4-2-3-5-13(11)10-17-15(18)12-6-8-14(9-7-12)21(16,19)20/h2-9H,10H2,1H3,(H,17,18)(H2,16,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038957 (CHEMBL65213 | N-Pyridin-2-ylmethyl-4-sulfamoyl-ben...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1ccccn1 Show InChI InChI=1S/C13H13N3O3S/c14-20(18,19)12-6-4-10(5-7-12)13(17)16-9-11-3-1-2-8-15-11/h1-8H,9H2,(H,16,17)(H2,14,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	4.30	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM12020 (2,3,4-trifluoro-SBB | 4-(AMINOSULFONYL)-N-[(2,3,4-...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1ccc(F)c(F)c1F Show InChI InChI=1S/C14H11F3N2O3S/c15-11-6-3-9(12(16)13(11)17)7-19-14(20)8-1-4-10(5-2-8)23(18,21)22/h1-6H,7H2,(H,19,20)(H2,18,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB PubMed	n/a	n/a	n/a	2.30	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038956 (CHEMBL63926 | {2-[(S)-2-Phenyl-2-(4-sulfamoyl-benz...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)OCc1ccccc1)c1ccccc1 Show InChI InChI=1S/C26H26N4O7S/c27-38(35,36)21-13-11-20(12-14-21)25(33)30-24(19-9-5-2-6-10-19)26(34)29-15-22(31)28-16-23(32)37-17-18-7-3-1-4-8-18/h1-14,24H,15-17H2,(H,28,31)(H,29,34)(H,30,33)(H2,27,35,36)/t24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	0.900	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038958 (CHEMBL63627 | N-(4-Dimethylamino-benzyl)-4-sulfamo...) Show SMILES CN(C)c1ccc(CNC(=O)c2ccc(cc2)S(N)(=O)=O)cc1 Show InChI InChI=1S/C16H19N3O3S/c1-19(2)14-7-3-12(4-8-14)11-18-16(20)13-5-9-15(10-6-13)23(17,21)22/h3-10H,11H2,1-2H3,(H,18,20)(H2,17,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038959 (CHEMBL433456 | {2-[(S)-3-Phenyl-2-(4-sulfamoyl-ben...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(=O)OCc1ccccc1 Show InChI InChI=1S/C27H28N4O7S/c28-39(36,37)22-13-11-21(12-14-22)26(34)31-23(15-19-7-3-1-4-8-19)27(35)30-16-24(32)29-17-25(33)38-18-20-9-5-2-6-10-20/h1-14,23H,15-18H2,(H,29,32)(H,30,35)(H,31,34)(H2,28,36,37)/t23-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	5.30	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038961 (CHEMBL67676 | N-Methyl-4-sulfamoyl-benzamide) Show SMILES CNC(=O)c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C8H10N2O3S/c1-10-8(11)6-2-4-7(5-3-6)14(9,12)13/h2-5H,1H3,(H,10,11)(H2,9,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038960 (CHEMBL302587 | {2-[(S)-3-Phenyl-2-(4-sulfamoyl-ben...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)NCC(O)=O Show InChI InChI=1S/C20H22N4O7S/c21-32(30,31)15-8-6-14(7-9-15)19(28)24-16(10-13-4-2-1-3-5-13)20(29)23-11-17(25)22-12-18(26)27/h1-9,16H,10-12H2,(H,22,25)(H,23,29)(H,24,28)(H,26,27)(H2,21,30,31)/t16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038962 (CHEMBL302105 | N-Adamantan-1-ylmethyl-4-sulfamoyl-...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCC12CC3CC(CC(C3)C1)C2 |TLB:17:18:22:16.15.21,21:20:23:16.15.17,21:16:23:20.22.19,THB:17:16:22:18.23.19,19:20:15:18.23.17,19:18:15:20.22.21| Show InChI InChI=1S/C18H24N2O3S/c19-24(22,23)16-3-1-15(2-4-16)17(21)20-11-18-8-12-5-13(9-18)7-14(6-12)10-18/h1-4,12-14H,5-11H2,(H,20,21)(H2,19,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038963 (CHEMBL67687 | {2-[2-(4-Sulfamoyl-benzoylamino)-ace...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCC(=O)NCC(=O)NCC(=O)OCc1ccccc1 Show InChI InChI=1S/C20H22N4O7S/c21-32(29,30)16-8-6-15(7-9-16)20(28)24-11-18(26)22-10-17(25)23-12-19(27)31-13-14-4-2-1-3-5-14/h1-9H,10-13H2,(H,22,26)(H,23,25)(H,24,28)(H2,21,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	75	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038965 (CHEMBL63396 | N-(2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-Pen...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F Show InChI InChI=1S/C15H9F15N2O3S/c16-9(17,5-32-8(33)6-1-3-7(4-2-6)36(31,34)35)10(18,19)11(20,21)12(22,23)13(24,25)14(26,27)15(28,29)30/h1-4H,5H2,(H,32,33)(H2,31,34,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038964 (CHEMBL294548 | N-Octyl-4-sulfamoyl-benzamide) Show SMILES CCCCCCCCNC(=O)c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H24N2O3S/c1-2-3-4-5-6-7-12-17-15(18)13-8-10-14(11-9-13)21(16,19)20/h8-11H,2-7,12H2,1H3,(H,17,18)(H2,16,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038966 (CHEMBL293628 | N-Cyclohexylmethyl-4-sulfamoyl-benz...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C14H20N2O3S/c15-20(18,19)13-8-6-12(7-9-13)14(17)16-10-11-4-2-1-3-5-11/h6-9,11H,1-5,10H2,(H,16,17)(H2,15,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM12013 (4-(AMINOSULFONYL)-N-PHENYLMETHYLBENZAMIDE | CHEMBL...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1ccccc1 Show InChI InChI=1S/C14H14N2O3S/c15-20(18,19)13-8-6-12(7-9-13)14(17)16-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,16,17)(H2,15,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB PubMed	n/a	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038967 (CHEMBL65489 | N-Phenylsulfanylmethyl-4-sulfamoyl-b...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCSc1ccccc1 Show InChI InChI=1S/C14H14N2O3S2/c15-21(18,19)13-8-6-11(7-9-13)14(17)16-10-20-12-4-2-1-3-5-12/h1-9H,10H2,(H,16,17)(H2,15,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	1.70	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038971 (CHEMBL305376 | N-(4-Nitro-benzyl)-4-sulfamoyl-benz...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C14H13N3O5S/c15-23(21,22)13-7-3-11(4-8-13)14(18)16-9-10-1-5-12(6-2-10)17(19)20/h1-8H,9H2,(H,16,18)(H2,15,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038970 (CHEMBL63626 | N-(Furan-2-carbonyl)-4-sulfamoyl-ben...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NC(=O)c1ccco1 Show InChI InChI=1S/C12H10N2O5S/c13-20(17,18)9-5-3-8(4-6-9)11(15)14-12(16)10-2-1-7-19-10/h1-7H,(H2,13,17,18)(H,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	5.60	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038969 ((2-{2-[2-(4-Sulfamoyl-benzoylamino)-acetylamino]-a...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)OCc1ccccc1 Show InChI InChI=1S/C22H25N5O8S/c23-36(33,34)17-8-6-16(7-9-17)22(32)27-12-20(30)25-10-18(28)24-11-19(29)26-13-21(31)35-14-15-4-2-1-3-5-15/h1-9H,10-14H2,(H,24,28)(H,25,30)(H,26,29)(H,27,32)(H2,23,33,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038968 (CHEMBL293626 | N-Naphthalen-1-ylmethyl-4-sulfamoyl...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1cccc2ccccc12 Show InChI InChI=1S/C18H16N2O3S/c19-24(22,23)16-10-8-14(9-11-16)18(21)20-12-15-6-3-5-13-4-1-2-7-17(13)15/h1-11H,12H2,(H,20,21)(H2,19,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038972 (CHEMBL304720 | {2-[2-(4-Sulfamoyl-benzoylamino)-ac...) Show SMILES CCCCc1ccc(COC(=O)CNC(=O)CNC(=O)CNC(=O)c2ccc(cc2)S(N)(=O)=O)cc1 Show InChI InChI=1S/C24H30N4O7S/c1-2-3-4-17-5-7-18(8-6-17)16-35-23(31)15-27-21(29)13-26-22(30)14-28-24(32)19-9-11-20(12-10-19)36(25,33)34/h5-12H,2-4,13-16H2,1H3,(H,26,30)(H,27,29)(H,28,32)(H2,25,33,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50038951 (CHEMBL63189 | N-Pyridin-3-ylmethyl-4-sulfamoyl-ben...) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C13H13N3O3S/c14-20(18,19)12-5-3-11(4-6-12)13(17)16-9-10-2-1-7-15-8-10/h1-8H,9H2,(H,16,17)(H2,14,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Dissociation constant against human Carbonic anhydrase II (HCA II)				J Med Chem 37: 2100-5 (1994) BindingDB Entry DOI: 10.7270/Q2TX3DDV
					More data for this Ligand-Target Pair