Compile Data Set for Download or QSAR

Found 78 hits Enz. Inhib. hit(s) with all data for entry = 50005736   

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))	BDBM50494039 (CHEMBL2443318) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(NCC(O)=O)n2)cc1 Show InChI InChI=1S/C13H15FN6O4S/c14-11-18-12(20-13(19-11)17-7-10(21)22)16-6-5-8-1-3-9(4-2-8)25(15,23)24/h1-4H,5-7H2,(H,21,22)(H2,15,23,24)(H2,16,17,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase12 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50494038 (CHEMBL2443314) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C11H11F2N5O2S/c12-9-16-10(13)18-11(17-9)15-6-5-7-1-3-8(4-2-7)21(14,19)20/h1-4H,5-6H2,(H2,14,19,20)(H,15,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase12 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50494037 (CHEMBL2443313) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C9H7F2N5O2S/c10-7-14-8(11)16-9(15-7)13-5-1-3-6(4-2-5)19(12,17)18/h1-4H,(H2,12,17,18)(H,13,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase2 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50494039 (CHEMBL2443318) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(NCC(O)=O)n2)cc1 Show InChI InChI=1S/C13H15FN6O4S/c14-11-18-12(20-13(19-11)17-7-10(21)22)16-6-5-8-1-3-9(4-2-8)25(15,23)24/h1-4H,5-7H2,(H,21,22)(H2,15,23,24)(H2,16,17,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase2 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50494035 (CHEMBL2443317) Show SMILES COC(=O)CNc1nc(F)nc(NCCc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C14H17FN6O4S/c1-25-11(22)8-18-14-20-12(15)19-13(21-14)17-7-6-9-2-4-10(5-3-9)26(16,23)24/h2-5H,6-8H2,1H3,(H2,16,23,24)(H2,17,18,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase12 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50494036 (CHEMBL2443316) Show SMILES CNc1nc(F)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C10H11FN6O2S/c1-13-9-15-8(11)16-10(17-9)14-6-2-4-7(5-3-6)20(12,18)19/h2-5H,1H3,(H2,12,18,19)(H2,13,14,15,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase2 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50494040 (CHEMBL2443315) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(NCCO)n2)cc1 Show InChI InChI=1S/C11H13FN6O3S/c12-9-16-10(14-5-6-19)18-11(17-9)15-7-1-3-8(4-2-7)22(13,20)21/h1-4,19H,5-6H2,(H2,13,20,21)(H2,14,15,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase2 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50494035 (CHEMBL2443317) Show SMILES COC(=O)CNc1nc(F)nc(NCCc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C14H17FN6O4S/c1-25-11(22)8-18-14-20-12(15)19-13(21-14)17-7-6-9-2-4-10(5-3-9)26(16,23)24/h2-5H,6-8H2,1H3,(H2,16,23,24)(H2,17,18,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase2 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 7 (Homo sapiens (Human))	BDBM50494037 (CHEMBL2443313) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C9H7F2N5O2S/c10-7-14-8(11)16-9(15-7)13-5-1-3-6(4-2-5)19(12,17)18/h1-4H,(H2,12,17,18)(H,13,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase7 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 7 (Homo sapiens (Human))	BDBM50494035 (CHEMBL2443317) Show SMILES COC(=O)CNc1nc(F)nc(NCCc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C14H17FN6O4S/c1-25-11(22)8-18-14-20-12(15)19-13(21-14)17-7-6-9-2-4-10(5-3-9)26(16,23)24/h2-5H,6-8H2,1H3,(H2,16,23,24)(H2,17,18,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase7 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 7 (Homo sapiens (Human))	BDBM50494036 (CHEMBL2443316) Show SMILES CNc1nc(F)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C10H11FN6O2S/c1-13-9-15-8(11)16-10(17-9)14-6-2-4-7(5-3-6)20(12,18)19/h2-5H,1H3,(H2,12,18,19)(H2,13,14,15,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase7 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50494038 (CHEMBL2443314) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C11H11F2N5O2S/c12-9-16-10(13)18-11(17-9)15-6-5-7-1-3-8(4-2-7)21(14,19)20/h1-4H,5-6H2,(H2,14,19,20)(H,15,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	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
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase2 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 7 (Homo sapiens (Human))	BDBM50494039 (CHEMBL2443318) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(NCC(O)=O)n2)cc1 Show InChI InChI=1S/C13H15FN6O4S/c14-11-18-12(20-13(19-11)17-7-10(21)22)16-6-5-8-1-3-9(4-2-8)25(15,23)24/h1-4H,5-7H2,(H,21,22)(H2,15,23,24)(H2,16,17,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase7 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 7 (Homo sapiens (Human))	BDBM50494040 (CHEMBL2443315) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(NCCO)n2)cc1 Show InChI InChI=1S/C11H13FN6O3S/c12-9-16-10(14-5-6-19)18-11(17-9)15-7-1-3-8(4-2-7)22(13,20)21/h1-4,19H,5-6H2,(H2,13,20,21)(H2,14,15,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase7 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50494037 (CHEMBL2443313) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C9H7F2N5O2S/c10-7-14-8(11)16-9(15-7)13-5-1-3-6(4-2-5)19(12,17)18/h1-4H,(H2,12,17,18)(H,13,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase12 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50494036 (CHEMBL2443316) Show SMILES CNc1nc(F)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C10H11FN6O2S/c1-13-9-15-8(11)16-10(17-9)14-6-2-4-7(5-3-6)20(12,18)19/h2-5H,1H3,(H2,12,18,19)(H2,13,14,15,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase12 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50494040 (CHEMBL2443315) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(NCCO)n2)cc1 Show InChI InChI=1S/C11H13FN6O3S/c12-9-16-10(14-5-6-19)18-11(17-9)15-7-1-3-8(4-2-7)22(13,20)21/h1-4,19H,5-6H2,(H2,13,20,21)(H2,14,15,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase12 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 7 (Homo sapiens (Human))	BDBM50494038 (CHEMBL2443314) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C11H11F2N5O2S/c12-9-16-10(13)18-11(17-9)15-6-5-7-1-3-8(4-2-7)21(14,19)20/h1-4H,5-6H2,(H2,14,19,20)(H,15,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase7 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50494038 (CHEMBL2443314) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C11H11F2N5O2S/c12-9-16-10(13)18-11(17-9)15-6-5-7-1-3-8(4-2-7)21(14,19)20/h1-4H,5-6H2,(H2,14,19,20)(H,15,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase9 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50494037 (CHEMBL2443313) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C9H7F2N5O2S/c10-7-14-8(11)16-9(15-7)13-5-1-3-6(4-2-5)19(12,17)18/h1-4H,(H2,12,17,18)(H,13,14,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase9 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50153972 (4-(4,6-Bis-methylamino-[1,3,5]triazin-2-ylamino)-b...) Show SMILES CNc1nc(NC)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C11H15N7O2S/c1-13-9-16-10(14-2)18-11(17-9)15-7-3-5-8(6-4-7)21(12,19)20/h3-6H,1-2H3,(H2,12,19,20)(H3,13,14,15,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase12 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50153972 (4-(4,6-Bis-methylamino-[1,3,5]triazin-2-ylamino)-b...) Show SMILES CNc1nc(NC)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C11H15N7O2S/c1-13-9-16-10(14-2)18-11(17-9)15-7-3-5-8(6-4-7)21(12,19)20/h3-6H,1-2H3,(H2,12,19,20)(H3,13,14,15,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase2 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair				3D Structure (docked)
Carbonic anhydrase 14 (Homo sapiens (Human))	BDBM50494038 (CHEMBL2443314) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C11H11F2N5O2S/c12-9-16-10(13)18-11(17-9)15-6-5-7-1-3-8(4-2-7)21(14,19)20/h1-4H,5-6H2,(H2,14,19,20)(H,15,16,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase14 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 7 (Homo sapiens (Human))	BDBM50153972 (4-(4,6-Bis-methylamino-[1,3,5]triazin-2-ylamino)-b...) Show SMILES CNc1nc(NC)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C11H15N7O2S/c1-13-9-16-10(14-2)18-11(17-9)15-7-3-5-8(6-4-7)21(12,19)20/h3-6H,1-2H3,(H2,12,19,20)(H3,13,14,15,16,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	45	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase7 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50494035 (CHEMBL2443317) Show SMILES COC(=O)CNc1nc(F)nc(NCCc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C14H17FN6O4S/c1-25-11(22)8-18-14-20-12(15)19-13(21-14)17-7-6-9-2-4-10(5-3-9)26(16,23)24/h2-5H,6-8H2,1H3,(H2,16,23,24)(H2,17,18,19,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	82	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase1 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50153972 (4-(4,6-Bis-methylamino-[1,3,5]triazin-2-ylamino)-b...) Show SMILES CNc1nc(NC)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C11H15N7O2S/c1-13-9-16-10(14-2)18-11(17-9)15-7-3-5-8(6-4-7)21(12,19)20/h3-6H,1-2H3,(H2,12,19,20)(H3,13,14,15,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	83	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase1 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50494037 (CHEMBL2443313) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C9H7F2N5O2S/c10-7-14-8(11)16-9(15-7)13-5-1-3-6(4-2-5)19(12,17)18/h1-4H,(H2,12,17,18)(H,13,14,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	88	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase1 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50494036 (CHEMBL2443316) Show SMILES CNc1nc(F)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C10H11FN6O2S/c1-13-9-15-8(11)16-10(17-9)14-6-2-4-7(5-3-6)20(12,18)19/h2-5H,1H3,(H2,12,18,19)(H2,13,14,15,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase1 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 14 (Homo sapiens (Human))	BDBM50494039 (CHEMBL2443318) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(NCC(O)=O)n2)cc1 Show InChI InChI=1S/C13H15FN6O4S/c14-11-18-12(20-13(19-11)17-7-10(21)22)16-6-5-8-1-3-9(4-2-8)25(15,23)24/h1-4H,5-7H2,(H,21,22)(H2,15,23,24)(H2,16,17,18,19,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	126	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase14 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 6 (Homo sapiens (Human))	BDBM50494037 (CHEMBL2443313) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C9H7F2N5O2S/c10-7-14-8(11)16-9(15-7)13-5-1-3-6(4-2-5)19(12,17)18/h1-4H,(H2,12,17,18)(H,13,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase6 secreted isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2 ...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 14 (Homo sapiens (Human))	BDBM50494037 (CHEMBL2443313) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C9H7F2N5O2S/c10-7-14-8(11)16-9(15-7)13-5-1-3-6(4-2-5)19(12,17)18/h1-4H,(H2,12,17,18)(H,13,14,15,16)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	138	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase14 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 6 (Homo sapiens (Human))	BDBM50153972 (4-(4,6-Bis-methylamino-[1,3,5]triazin-2-ylamino)-b...) Show SMILES CNc1nc(NC)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C11H15N7O2S/c1-13-9-16-10(14-2)18-11(17-9)15-7-3-5-8(6-4-7)21(12,19)20/h3-6H,1-2H3,(H2,12,19,20)(H3,13,14,15,16,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	147	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase6 secreted isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2 ...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 6 (Homo sapiens (Human))	BDBM50494039 (CHEMBL2443318) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(NCC(O)=O)n2)cc1 Show InChI InChI=1S/C13H15FN6O4S/c14-11-18-12(20-13(19-11)17-7-10(21)22)16-6-5-8-1-3-9(4-2-8)25(15,23)24/h1-4H,5-7H2,(H,21,22)(H2,15,23,24)(H2,16,17,18,19,20)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	148	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase6 secreted isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2 ...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50153972 (4-(4,6-Bis-methylamino-[1,3,5]triazin-2-ylamino)-b...) Show SMILES CNc1nc(NC)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C11H15N7O2S/c1-13-9-16-10(14-2)18-11(17-9)15-7-3-5-8(6-4-7)21(12,19)20/h3-6H,1-2H3,(H2,12,19,20)(H3,13,14,15,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	153	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase9 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 6 (Homo sapiens (Human))	BDBM50494035 (CHEMBL2443317) Show SMILES COC(=O)CNc1nc(F)nc(NCCc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C14H17FN6O4S/c1-25-11(22)8-18-14-20-12(15)19-13(21-14)17-7-6-9-2-4-10(5-3-9)26(16,23)24/h2-5H,6-8H2,1H3,(H2,16,23,24)(H2,17,18,19,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	167	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase6 secreted isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2 ...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50494035 (CHEMBL2443317) Show SMILES COC(=O)CNc1nc(F)nc(NCCc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C14H17FN6O4S/c1-25-11(22)8-18-14-20-12(15)19-13(21-14)17-7-6-9-2-4-10(5-3-9)26(16,23)24/h2-5H,6-8H2,1H3,(H2,16,23,24)(H2,17,18,19,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	199	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase9 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50494038 (CHEMBL2443314) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C11H11F2N5O2S/c12-9-16-10(13)18-11(17-9)15-6-5-7-1-3-8(4-2-7)21(14,19)20/h1-4H,5-6H2,(H2,14,19,20)(H,15,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	203	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase1 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50494040 (CHEMBL2443315) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(NCCO)n2)cc1 Show InChI InChI=1S/C11H13FN6O3S/c12-9-16-10(14-5-6-19)18-11(17-9)15-7-1-3-8(4-2-7)22(13,20)21/h1-4,19H,5-6H2,(H2,13,20,21)(H2,14,15,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	208	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase9 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 14 (Homo sapiens (Human))	BDBM50494035 (CHEMBL2443317) Show SMILES COC(=O)CNc1nc(F)nc(NCCc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C14H17FN6O4S/c1-25-11(22)8-18-14-20-12(15)19-13(21-14)17-7-6-9-2-4-10(5-3-9)26(16,23)24/h2-5H,6-8H2,1H3,(H2,16,23,24)(H2,17,18,19,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	214	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase14 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50494039 (CHEMBL2443318) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(NCC(O)=O)n2)cc1 Show InChI InChI=1S/C13H15FN6O4S/c14-11-18-12(20-13(19-11)17-7-10(21)22)16-6-5-8-1-3-9(4-2-8)25(15,23)24/h1-4H,5-7H2,(H,21,22)(H2,15,23,24)(H2,16,17,18,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	214	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase9 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 6 (Homo sapiens (Human))	BDBM50494040 (CHEMBL2443315) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(NCCO)n2)cc1 Show InChI InChI=1S/C11H13FN6O3S/c12-9-16-10(14-5-6-19)18-11(17-9)15-7-1-3-8(4-2-7)22(13,20)21/h1-4,19H,5-6H2,(H2,13,20,21)(H2,14,15,16,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	220	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase6 secreted isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2 ...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 14 (Homo sapiens (Human))	BDBM50494040 (CHEMBL2443315) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(NCCO)n2)cc1 Show InChI InChI=1S/C11H13FN6O3S/c12-9-16-10(14-5-6-19)18-11(17-9)15-7-1-3-8(4-2-7)22(13,20)21/h1-4,19H,5-6H2,(H2,13,20,21)(H2,14,15,16,17,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	220	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase14 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50494036 (CHEMBL2443316) Show SMILES CNc1nc(F)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C10H11FN6O2S/c1-13-9-15-8(11)16-10(17-9)14-6-2-4-7(5-3-6)20(12,18)19/h2-5H,1H3,(H2,12,18,19)(H2,13,14,15,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	228	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase9 transmembrane isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50494040 (CHEMBL2443315) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(F)nc(NCCO)n2)cc1 Show InChI InChI=1S/C11H13FN6O3S/c12-9-16-10(14-5-6-19)18-11(17-9)15-7-1-3-8(4-2-7)22(13,20)21/h1-4,19H,5-6H2,(H2,13,20,21)(H2,14,15,16,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	238	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase1 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50494039 (CHEMBL2443318) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(NCC(O)=O)n2)cc1 Show InChI InChI=1S/C13H15FN6O4S/c14-11-18-12(20-13(19-11)17-7-10(21)22)16-6-5-8-1-3-9(4-2-8)25(15,23)24/h1-4H,5-7H2,(H,21,22)(H2,15,23,24)(H2,16,17,18,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	250	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase1 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 6 (Homo sapiens (Human))	BDBM50494036 (CHEMBL2443316) Show SMILES CNc1nc(F)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C10H11FN6O2S/c1-13-9-15-8(11)16-10(17-9)14-6-2-4-7(5-3-6)20(12,18)19/h2-5H,1H3,(H2,12,18,19)(H2,13,14,15,16,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	274	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase6 secreted isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2 ...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 13 (Homo sapiens (Human))	BDBM50494038 (CHEMBL2443314) Show SMILES NS(=O)(=O)c1ccc(CCNc2nc(F)nc(F)n2)cc1 Show InChI InChI=1S/C11H11F2N5O2S/c12-9-16-10(13)18-11(17-9)15-6-5-7-1-3-8(4-2-7)21(14,19)20/h1-4H,5-6H2,(H2,14,19,20)(H,15,16,17,18)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	470	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase13 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 13 (Homo sapiens (Human))	BDBM50494035 (CHEMBL2443317) Show SMILES COC(=O)CNc1nc(F)nc(NCCc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C14H17FN6O4S/c1-25-11(22)8-18-14-20-12(15)19-13(21-14)17-7-6-9-2-4-10(5-3-9)26(16,23)24/h2-5H,6-8H2,1H3,(H2,16,23,24)(H2,17,18,19,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	602	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase13 cytosolic isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 4 (Homo sapiens (Human))	BDBM50494036 (CHEMBL2443316) Show SMILES CNc1nc(F)nc(Nc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C10H11FN6O2S/c1-13-9-15-8(11)16-10(17-9)14-6-2-4-7(5-3-6)20(12,18)19/h2-5H,1H3,(H2,12,18,19)(H2,13,14,15,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	603	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase4 membrane-bound isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial (Homo sapiens (Human))	BDBM50494035 (CHEMBL2443317) Show SMILES COC(=O)CNc1nc(F)nc(NCCc2ccc(cc2)S(N)(=O)=O)n1 Show InChI InChI=1S/C14H17FN6O4S/c1-25-11(22)8-18-14-20-12(15)19-13(21-14)17-7-6-9-2-4-10(5-3-9)26(16,23)24/h2-5H,6-8H2,1H3,(H2,16,23,24)(H2,17,18,19,20,21)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	650	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase5A mitochondrial isoform expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flo...				Bioorg Med Chem 21: 6929-36 (2013) Article DOI: 10.1016/j.bmc.2013.09.031 BindingDB Entry DOI: 10.7270/Q2NG4TKD
					More data for this Ligand-Target Pair

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