Compile Data Set for Download or QSAR

Found 88 hits Enz. Inhib. hit(s) with all data for entry = 50048921   

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 12 (Homo sapiens (Human))	BDBM50226748 (CHEMBL4080055) Show SMILES Cl.NC(=N)NC(=N)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C10H16N6O2S/c11-9(12)16-10(13)15-6-5-7-1-3-8(4-2-7)19(14,17)18/h1-4H,5-6H2,(H2,14,17,18)(H6,11,12,13,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (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	PDB Article PubMed	5.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50227244 (CHEMBL4096322) Show SMILES NS(=O)(=O)c1ccc(CCNc2n[n+]([O-])c3ccccc3[n+]2[O-])cc1 Show InChI InChI=1S/C15H15N5O4S/c16-25(23,24)12-7-5-11(6-8-12)9-10-17-15-18-20(22)14-4-2-1-3-13(14)19(15)21/h1-8H,9-10H2,(H,17,18)(H2,16,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	7.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50226807 (CHEMBL4101650) Show SMILES NS(=O)(=O)c1ccc(CCNc2n[n+]([O-])c3cc4CCCc4cc3[n+]2[O-])cc1 Show InChI InChI=1S/C18H19N5O4S/c19-28(26,27)15-6-4-12(5-7-15)8-9-20-18-21-23(25)17-11-14-3-1-2-13(14)10-16(17)22(18)24/h4-7,10-11H,1-3,8-9H2,(H,20,21)(H2,19,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50226749 (CHEMBL4083817) Show SMILES NS(=O)(=O)c1ccc(NC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C20H25Cl2N3O3S/c21-12-14-25(15-13-22)18-8-4-16(5-9-18)2-1-3-20(26)24-17-6-10-19(11-7-17)29(23,27)28/h4-11H,1-3,12-15H2,(H,24,26)(H2,23,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50226809 (CHEMBL4075724) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H15N7O4S/c1-20-14(23)21-8-17-11(12(21)18-19-20)13(22)16-7-6-9-2-4-10(5-3-9)26(15,24)25/h2-5,8H,6-7H2,1H3,(H,16,22)(H2,15,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					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 Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50226919 (CHEMBL4099011) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C8H7N9O4S2/c1-16-8(19)17-2-10-3(4(17)12-15-16)5(18)11-6-13-14-7(22-6)23(9,20)21/h2H,1H3,(H2,9,20,21)(H,11,13,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50226748 (CHEMBL4080055) Show SMILES Cl.NC(=N)NC(=N)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C10H16N6O2S/c11-9(12)16-10(13)15-6-5-7-1-3-8(4-2-7)19(14,17)18/h1-4H,5-6H2,(H2,14,17,18)(H6,11,12,13,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (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 NCI pathway 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	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50226809 (CHEMBL4075724) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H15N7O4S/c1-20-14(23)21-8-17-11(12(21)18-19-20)13(22)16-7-6-9-2-4-10(5-3-9)26(15,24)25/h2-5,8H,6-7H2,1H3,(H,16,22)(H2,15,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	37	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50226749 (CHEMBL4083817) Show SMILES NS(=O)(=O)c1ccc(NC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C20H25Cl2N3O3S/c21-12-14-25(15-13-22)18-8-4-16(5-9-18)2-1-3-20(26)24-17-6-10-19(11-7-17)29(23,27)28/h4-11H,1-3,12-15H2,(H,24,26)(H2,23,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	73	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50226809 (CHEMBL4075724) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H15N7O4S/c1-20-14(23)21-8-17-11(12(21)18-19-20)13(22)16-7-6-9-2-4-10(5-3-9)26(15,24)25/h2-5,8H,6-7H2,1H3,(H,16,22)(H2,15,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	91	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50226857 (CHEMBL4072049) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C13H13N7O4S/c1-19-13(22)20-7-16-10(11(20)17-18-19)12(21)15-6-8-2-4-9(5-3-8)25(14,23)24/h2-5,7H,6H2,1H3,(H,15,21)(H2,14,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	91	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50226919 (CHEMBL4099011) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C8H7N9O4S2/c1-16-8(19)17-2-10-3(4(17)12-15-16)5(18)11-6-13-14-7(22-6)23(9,20)21/h2H,1H3,(H2,9,20,21)(H,11,13,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	93	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50226749 (CHEMBL4083817) Show SMILES NS(=O)(=O)c1ccc(NC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C20H25Cl2N3O3S/c21-12-14-25(15-13-22)18-8-4-16(5-9-18)2-1-3-20(26)24-17-6-10-19(11-7-17)29(23,27)28/h4-11H,1-3,12-15H2,(H,24,26)(H2,23,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	172	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50226919 (CHEMBL4099011) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C8H7N9O4S2/c1-16-8(19)17-2-10-3(4(17)12-15-16)5(18)11-6-13-14-7(22-6)23(9,20)21/h2H,1H3,(H2,9,20,21)(H,11,13,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	176	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (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 NCI pathway 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 PDB Article PubMed	250	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50227247 (CHEMBL4073786) Show SMILES NS(=O)(=O)c1ccc(CNC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C22H29Cl2N3O4S/c23-12-14-27(15-13-24)20-8-4-18(5-9-20)3-1-2-16-31-22(28)26-17-19-6-10-21(11-7-19)32(25,29)30/h4-11H,1-3,12-17H2,(H,26,28)(H2,25,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	265	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50226857 (CHEMBL4072049) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C13H13N7O4S/c1-19-13(22)20-7-16-10(11(20)17-18-19)12(21)15-6-8-2-4-9(5-3-8)25(14,23)24/h2-5,7H,6H2,1H3,(H,15,21)(H2,14,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	271	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50226807 (CHEMBL4101650) Show SMILES NS(=O)(=O)c1ccc(CCNc2n[n+]([O-])c3cc4CCCc4cc3[n+]2[O-])cc1 Show InChI InChI=1S/C18H19N5O4S/c19-28(26,27)15-6-4-12(5-7-15)8-9-20-18-21-23(25)17-11-14-3-1-2-13(14)10-16(17)22(18)24/h4-7,10-11H,1-3,8-9H2,(H,20,21)(H2,19,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	307	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50227244 (CHEMBL4096322) Show SMILES NS(=O)(=O)c1ccc(CCNc2n[n+]([O-])c3ccccc3[n+]2[O-])cc1 Show InChI InChI=1S/C15H15N5O4S/c16-25(23,24)12-7-5-11(6-8-12)9-10-17-15-18-20(22)14-4-2-1-3-13(14)19(15)21/h1-8H,9-10H2,(H,17,18)(H2,16,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	383	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50226807 (CHEMBL4101650) Show SMILES NS(=O)(=O)c1ccc(CCNc2n[n+]([O-])c3cc4CCCc4cc3[n+]2[O-])cc1 Show InChI InChI=1S/C18H19N5O4S/c19-28(26,27)15-6-4-12(5-7-15)8-9-20-18-21-23(25)17-11-14-3-1-2-13(14)10-16(17)22(18)24/h4-7,10-11H,1-3,8-9H2,(H,20,21)(H2,19,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	428	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50227243 (CHEMBL4080734) Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C22H29Cl2N3O3S/c23-13-16-27(17-14-24)20-8-4-18(5-9-20)2-1-3-22(28)26-15-12-19-6-10-21(11-7-19)31(25,29)30/h4-11H,1-3,12-17H2,(H,26,28)(H2,25,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	450	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50226748 (CHEMBL4080055) Show SMILES Cl.NC(=N)NC(=N)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C10H16N6O2S/c11-9(12)16-10(13)15-6-5-7-1-3-8(4-2-7)19(14,17)18/h1-4H,5-6H2,(H2,14,17,18)(H6,11,12,13,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	501	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50226805 (CHEMBL4095964) Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C23H31Cl2N3O4S/c24-13-16-28(17-14-25)21-8-4-19(5-9-21)3-1-2-18-32-23(29)27-15-12-20-6-10-22(11-7-20)33(26,30)31/h4-11H,1-3,12-18H2,(H,27,29)(H2,26,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	504	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50226857 (CHEMBL4072049) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C13H13N7O4S/c1-19-13(22)20-7-16-10(11(20)17-18-19)12(21)15-6-8-2-4-9(5-3-8)25(14,23)24/h2-5,7H,6H2,1H3,(H,15,21)(H2,14,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	539	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50226803 (CHEMBL4069462) Show SMILES NS(=O)(=O)c1ccc(NC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C21H27Cl2N3O4S/c22-12-14-26(15-13-23)19-8-4-17(5-9-19)3-1-2-16-30-21(27)25-18-6-10-20(11-7-18)31(24,28)29/h4-11H,1-3,12-16H2,(H,25,27)(H2,24,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	553	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50227244 (CHEMBL4096322) Show SMILES NS(=O)(=O)c1ccc(CCNc2n[n+]([O-])c3ccccc3[n+]2[O-])cc1 Show InChI InChI=1S/C15H15N5O4S/c16-25(23,24)12-7-5-11(6-8-12)9-10-17-15-18-20(22)14-4-2-1-3-13(14)19(15)21/h1-8H,9-10H2,(H,17,18)(H2,16,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	567	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50226807 (CHEMBL4101650) Show SMILES NS(=O)(=O)c1ccc(CCNc2n[n+]([O-])c3cc4CCCc4cc3[n+]2[O-])cc1 Show InChI InChI=1S/C18H19N5O4S/c19-28(26,27)15-6-4-12(5-7-15)8-9-20-18-21-23(25)17-11-14-3-1-2-13(14)10-16(17)22(18)24/h4-7,10-11H,1-3,8-9H2,(H,20,21)(H2,19,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	624	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50226749 (CHEMBL4083817) Show SMILES NS(=O)(=O)c1ccc(NC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C20H25Cl2N3O3S/c21-12-14-25(15-13-22)18-8-4-16(5-9-18)2-1-3-20(26)24-17-6-10-19(11-7-17)29(23,27)28/h4-11H,1-3,12-15H2,(H,24,26)(H2,23,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	689	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50226919 (CHEMBL4099011) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C8H7N9O4S2/c1-16-8(19)17-2-10-3(4(17)12-15-16)5(18)11-6-13-14-7(22-6)23(9,20)21/h2H,1H3,(H2,9,20,21)(H,11,13,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	743	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50226750 (CHEMBL4101563) Show SMILES NS(=O)(=O)c1ccc(CNC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C21H27Cl2N3O3S/c22-12-14-26(15-13-23)19-8-4-17(5-9-19)2-1-3-21(27)25-16-18-6-10-20(11-7-18)30(24,28)29/h4-11H,1-3,12-16H2,(H,25,27)(H2,24,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	747	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 2 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50226803 (CHEMBL4069462) Show SMILES NS(=O)(=O)c1ccc(NC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C21H27Cl2N3O4S/c22-12-14-26(15-13-23)19-8-4-17(5-9-19)3-1-2-16-30-21(27)25-18-6-10-20(11-7-18)31(24,28)29/h4-11H,1-3,12-16H2,(H,25,27)(H2,24,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.74E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50226805 (CHEMBL4095964) Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C23H31Cl2N3O4S/c24-13-16-28(17-14-25)21-8-4-19(5-9-21)3-1-2-18-32-23(29)27-15-12-20-6-10-22(11-7-20)33(26,30)31/h4-11H,1-3,12-18H2,(H,27,29)(H2,26,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.85E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50227247 (CHEMBL4073786) Show SMILES NS(=O)(=O)c1ccc(CNC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C22H29Cl2N3O4S/c23-12-14-27(15-13-24)20-8-4-18(5-9-20)3-1-2-16-31-22(28)26-17-19-6-10-21(11-7-19)32(25,29)30/h4-11H,1-3,12-17H2,(H,26,28)(H2,25,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.13E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50226748 (CHEMBL4080055) Show SMILES Cl.NC(=N)NC(=N)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C10H16N6O2S/c11-9(12)16-10(13)15-6-5-7-1-3-8(4-2-7)19(14,17)18/h1-4H,5-6H2,(H2,14,17,18)(H6,11,12,13,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.44E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50227243 (CHEMBL4080734) Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C22H29Cl2N3O3S/c23-13-16-27(17-14-24)20-8-4-18(5-9-20)2-1-3-22(28)26-15-12-19-6-10-21(11-7-19)31(25,29)30/h4-11H,1-3,12-17H2,(H,26,28)(H2,25,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.61E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50226803 (CHEMBL4069462) Show SMILES NS(=O)(=O)c1ccc(NC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C21H27Cl2N3O4S/c22-12-14-26(15-13-23)19-8-4-17(5-9-19)3-1-2-16-30-21(27)25-18-6-10-20(11-7-18)31(24,28)29/h4-11H,1-3,12-16H2,(H,25,27)(H2,24,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.58E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50226805 (CHEMBL4095964) Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C23H31Cl2N3O4S/c24-13-16-28(17-14-25)21-8-4-19(5-9-21)3-1-2-18-32-23(29)27-15-12-20-6-10-22(11-7-20)33(26,30)31/h4-11H,1-3,12-18H2,(H,27,29)(H2,26,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.67E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50226750 (CHEMBL4101563) Show SMILES NS(=O)(=O)c1ccc(CNC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C21H27Cl2N3O3S/c22-12-14-26(15-13-23)19-8-4-17(5-9-19)2-1-3-21(27)25-16-18-6-10-20(11-7-18)30(24,28)29/h4-11H,1-3,12-16H2,(H,25,27)(H2,24,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5.95E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50227247 (CHEMBL4073786) Show SMILES NS(=O)(=O)c1ccc(CNC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C22H29Cl2N3O4S/c23-12-14-27(15-13-24)20-8-4-18(5-9-20)3-1-2-16-31-22(28)26-17-19-6-10-21(11-7-19)32(25,29)30/h4-11H,1-3,12-17H2,(H,26,28)(H2,25,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.14E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50226750 (CHEMBL4101563) Show SMILES NS(=O)(=O)c1ccc(CNC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C21H27Cl2N3O3S/c22-12-14-26(15-13-23)19-8-4-17(5-9-19)2-1-3-21(27)25-16-18-6-10-20(11-7-18)30(24,28)29/h4-11H,1-3,12-16H2,(H,25,27)(H2,24,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	7.34E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50227243 (CHEMBL4080734) Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C22H29Cl2N3O3S/c23-13-16-27(17-14-24)20-8-4-18(5-9-20)2-1-3-22(28)26-15-12-19-6-10-21(11-7-19)31(25,29)30/h4-11H,1-3,12-17H2,(H,26,28)(H2,25,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.40E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 1 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50226750 (CHEMBL4101563) Show SMILES NS(=O)(=O)c1ccc(CNC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C21H27Cl2N3O3S/c22-12-14-26(15-13-23)19-8-4-17(5-9-19)2-1-3-21(27)25-16-18-6-10-20(11-7-18)30(24,28)29/h4-11H,1-3,12-16H2,(H,25,27)(H2,24,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	8.97E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 9 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50226809 (CHEMBL4075724) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H15N7O4S/c1-20-14(23)21-8-17-11(12(21)18-19-20)13(22)16-7-6-9-2-4-10(5-3-9)26(15,24)25/h2-5,8H,6-7H2,1H3,(H,16,22)(H2,15,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50226803 (CHEMBL4069462) Show SMILES NS(=O)(=O)c1ccc(NC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C21H27Cl2N3O4S/c22-12-14-26(15-13-23)19-8-4-17(5-9-19)3-1-2-16-30-21(27)25-18-6-10-20(11-7-18)31(24,28)29/h4-11H,1-3,12-16H2,(H,25,27)(H2,24,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.38E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50227247 (CHEMBL4073786) Show SMILES NS(=O)(=O)c1ccc(CNC(=O)OCCCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C22H29Cl2N3O4S/c23-12-14-27(15-13-24)20-8-4-18(5-9-20)3-1-2-16-31-22(28)26-17-19-6-10-21(11-7-19)32(25,29)30/h4-11H,1-3,12-17H2,(H,26,28)(H2,25,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.57E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50227243 (CHEMBL4080734) Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)CCCc2ccc(cc2)N(CCCl)CCCl)cc1 Show InChI InChI=1S/C22H29Cl2N3O3S/c23-13-16-27(17-14-24)20-8-4-18(5-9-20)2-1-3-22(28)26-15-12-19-6-10-21(11-7-19)31(25,29)30/h4-11H,1-3,12-17H2,(H,26,28)(H2,25,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.02E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50226857 (CHEMBL4072049) Show SMILES Cn1nnc2c(ncn2c1=O)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C13H13N7O4S/c1-19-13(22)20-7-16-10(11(20)17-18-19)12(21)15-6-8-2-4-9(5-3-8)25(14,23)24/h2-5,7H,6H2,1H3,(H,15,21)(H2,14,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Maastricht University Medical Centre Curated by ChEMBL					Assay Description Binding affinity to recombinant human carbonic anhydrase 12 after 15 mins by stopped-flow CO2 hydration assay				Eur J Med Chem 127: 691-702 (2017) Article DOI: 10.1016/j.ejmech.2016.10.037 BindingDB Entry DOI: 10.7270/Q2MK6G3G
					More data for this Ligand-Target Pair

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