Compile Data Set for Download or QSAR

Found 376 hits with Last Name = 'pala' and Initial = 'n'   

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))	BDBM50058941 (CHEMBL3326411) Show SMILES NS(=O)(=O)c1c(F)c(F)c(c(F)c1F)-n1cc(nn1)C1CCCCC1 Show InChI InChI=1S/C14H14F4N4O2S/c15-9-11(17)14(25(19,23)24)12(18)10(16)13(9)22-6-8(20-21-22)7-4-2-1-3-5-7/h6-7H,1-5H2,(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Translocator protein (Rattus norvegicus (rat))	BDBM50232182 (CHEMBL4097327) Show SMILES CCC(CC)C(=O)Cc1c(nn2c(C)cc(C)nc12)-c1ccc(C)cc1 Show InChI InChI=1S/C22H27N3O/c1-6-17(7-2)20(26)13-19-21(18-10-8-14(3)9-11-18)24-25-16(5)12-15(4)23-22(19)25/h8-12,17H,6-7,13H2,1-5H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from PBZR in rat kidney mitochondrial membranes measured after 90 mins by liquid scintillation counting				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059068 (CHEMBL3326413) Show SMILES NS(=O)(=O)c1c(F)c(F)c(c(F)c1F)-n1cc(CCBr)nn1 Show InChI InChI=1S/C10H7BrF4N4O2S/c11-2-1-4-3-19(18-17-4)9-5(12)7(14)10(22(16,20)21)8(15)6(9)13/h3H,1-2H2,(H2,16,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059069 (CHEMBL3326414) Show SMILES NS(=O)(=O)c1c(F)c(F)c(c(F)c1F)-n1cc(CCCCl)nn1 Show InChI InChI=1S/C11H9ClF4N4O2S/c12-3-1-2-5-4-20(19-18-5)10-6(13)8(15)11(23(17,21)22)9(16)7(10)14/h4H,1-3H2,(H2,17,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50087713 ((1-Ethyl-propyl)-[3-(4-methoxy-2-methyl-phenyl)-2,...) Show SMILES CCC(CC)Nc1cc(C)nc2c(c(C)nn12)-c1ccc(OC)cc1C |(-4.03,1.25,;-2.68,.48,;-1.35,1.27,;-1.37,2.81,;-2.86,3.21,;-.02,.5,;-.02,-1.04,;-1.34,-1.81,;-1.34,-3.35,;-2.66,-4.12,;,-4.12,;1.33,-3.35,;2.8,-3.8,;3.7,-2.55,;5.24,-2.53,;2.77,-1.32,;1.33,-1.81,;3.3,-5.26,;2.28,-6.39,;2.77,-7.87,;4.28,-8.16,;4.78,-9.63,;3.76,-10.79,;5.3,-7,;4.79,-5.55,;5.82,-4.4,)| Show InChI InChI=1S/C21H28N4O/c1-7-16(8-2)23-19-12-14(4)22-21-20(15(5)24-25(19)21)18-10-9-17(26-6)11-13(18)3/h9-12,16,23H,7-8H2,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [125I-Tyr0]-CRF from recombinant human CRF1 receptor				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059070 (CHEMBL3326415) Show SMILES NS(=O)(=O)c1c(F)c(F)c(c(F)c1F)-n1cc(CCCCCl)nn1 Show InChI InChI=1S/C12H11ClF4N4O2S/c13-4-2-1-3-6-5-21(20-19-6)11-7(14)9(16)12(24(18,22)23)10(17)8(11)15/h5H,1-4H2,(H2,18,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Translocator protein (Rattus norvegicus (rat))	BDBM50232188 (CHEMBL4070141) Show SMILES CCC(CC)C(=O)Cc1c(nn2c(C)cc(C)nc12)-c1ccc(Cl)cc1 Show InChI InChI=1S/C21H24ClN3O/c1-5-15(6-2)19(26)12-18-20(16-7-9-17(22)10-8-16)24-25-14(4)11-13(3)23-21(18)25/h7-11,15H,5-6,12H2,1-4H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]Ro5-4864 from PBZR in rat kidney mitochondrial membranes measured after 90 mins by liquid scintillation counting				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50058937 (CHEMBL3326401) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(nn1)C1CCCCC1 Show InChI InChI=1S/C14H18N4O2S/c15-21(19,20)13-8-6-12(7-9-13)18-10-14(16-17-18)11-4-2-1-3-5-11/h6-11H,1-5H2,(H2,15,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50058941 (CHEMBL3326411) Show SMILES NS(=O)(=O)c1c(F)c(F)c(c(F)c1F)-n1cc(nn1)C1CCCCC1 Show InChI InChI=1S/C14H14F4N4O2S/c15-9-11(17)14(25(19,23)24)12(18)10(16)13(9)22-6-8(20-21-22)7-4-2-1-3-5-7/h6-7H,1-5H2,(H2,19,23,24)	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	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50232179 (CHEMBL4105538) Show SMILES CCC(CC)Nc1cc(C)nc2c(c(C)nn12)-c1ccc(C)cc1Cl |(40.46,-5.09,;39.13,-5.86,;39.13,-7.4,;40.46,-8.17,;41.79,-7.4,;37.79,-8.17,;37.79,-9.71,;36.46,-10.48,;36.46,-12.02,;35.13,-12.8,;37.79,-12.79,;39.12,-12.03,;40.59,-12.5,;41.49,-11.26,;43.03,-11.26,;40.59,-10.01,;39.12,-10.48,;41.06,-13.97,;40.03,-15.1,;40.5,-16.57,;42.01,-16.89,;42.49,-18.35,;43.04,-15.73,;42.56,-14.28,;43.59,-13.12,)| Show InChI InChI=1S/C20H25ClN4/c1-6-15(7-2)23-18-11-13(4)22-20-19(14(5)24-25(18)20)16-9-8-12(3)10-17(16)21/h8-11,15,23H,6-7H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [125I-Tyr0]-CRF from recombinant human CRF1 receptor				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50232178 (CHEMBL4081285) Show SMILES CCC(CC)Nc1cc(C)nc2c(c(C)nn12)-c1ccc(Cl)cc1C |(28.23,-5.21,;26.9,-5.98,;26.9,-7.52,;28.23,-8.29,;29.57,-7.52,;25.56,-8.29,;25.56,-9.83,;24.24,-10.61,;24.24,-12.15,;22.9,-12.92,;25.56,-12.91,;26.89,-12.15,;28.36,-12.63,;29.27,-11.38,;30.81,-11.38,;28.36,-10.13,;26.89,-10.61,;28.84,-14.09,;27.8,-15.23,;28.28,-16.69,;29.78,-17.01,;30.26,-18.48,;30.82,-15.86,;30.34,-14.4,;31.36,-13.25,)| Show InChI InChI=1S/C20H25ClN4/c1-6-16(7-2)23-18-11-13(4)22-20-19(14(5)24-25(18)20)17-9-8-15(21)10-12(17)3/h8-11,16,23H,6-7H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD 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
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [125I-Tyr0]-CRF from recombinant human CRF1 receptor				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Translocator protein (Rattus norvegicus (rat))	BDBM50232182 (CHEMBL4097327) Show SMILES CCC(CC)C(=O)Cc1c(nn2c(C)cc(C)nc12)-c1ccc(C)cc1 Show InChI InChI=1S/C22H27N3O/c1-6-17(7-2)20(26)13-19-21(18-10-8-14(3)9-11-18)24-25-16(5)12-15(4)23-22(19)25/h8-12,17H,6-7,13H2,1-5H3	PDB KEGG UniProtKB/SwissProt 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
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]Ro5-4864 from PBZR in rat kidney mitochondrial membranes measured after 90 mins by liquid scintillation counting				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059080 (CHEMBL3326409) Show SMILES Cc1ccc(cc1)-c1cn(nn1)-c1c(F)c(F)c(c(F)c1F)S(N)(=O)=O Show InChI InChI=1S/C15H10F4N4O2S/c1-7-2-4-8(5-3-7)9-6-23(22-21-9)14-10(16)12(18)15(26(20,24)25)13(19)11(14)17/h2-6H,1H3,(H2,20,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059078 (CHEMBL3326407) Show SMILES CC(C)(C)OC(=O)NCc1cn(nn1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H19N5O4S/c1-14(2,3)23-13(20)16-8-10-9-19(18-17-10)11-4-6-12(7-5-11)24(15,21)22/h4-7,9H,8H2,1-3H3,(H,16,20)(H2,15,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059076 (CHEMBL3326405) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CCCCCl)nn1 Show InChI InChI=1S/C12H15ClN4O2S/c13-8-2-1-3-10-9-17(16-15-10)11-4-6-12(7-5-11)20(14,18)19/h4-7,9H,1-3,8H2,(H2,14,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059075 (CHEMBL3326404) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CCCCl)nn1 Show InChI InChI=1S/C11H13ClN4O2S/c12-7-1-2-9-8-16(15-14-9)10-3-5-11(6-4-10)19(13,17)18/h3-6,8H,1-2,7H2,(H2,13,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Translocator protein (Rattus norvegicus (rat))	BDBM50232191 (CHEMBL4089611) Show SMILES CCC(CC)C(=O)Cc1c(nn2c(cc(C)nc12)-c1ccccc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C26H26ClN3O/c1-4-18(5-2)24(31)16-22-25(20-11-13-21(27)14-12-20)29-30-23(15-17(3)28-26(22)30)19-9-7-6-8-10-19/h6-15,18H,4-5,16H2,1-3H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from PBZR in rat kidney mitochondrial membranes measured after 90 mins by liquid scintillation counting				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Translocator protein (Rattus norvegicus (rat))	BDBM50232188 (CHEMBL4070141) Show SMILES CCC(CC)C(=O)Cc1c(nn2c(C)cc(C)nc12)-c1ccc(Cl)cc1 Show InChI InChI=1S/C21H24ClN3O/c1-5-15(6-2)19(26)12-18-20(16-7-9-17(22)10-8-16)24-25-14(4)11-13(3)23-21(18)25/h7-11,15H,5-6,12H2,1-4H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from PBZR in rat kidney mitochondrial membranes measured after 90 mins by liquid scintillation counting				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059074 (CHEMBL3326403) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CCBr)nn1 Show InChI InChI=1S/C10H11BrN4O2S/c11-6-5-8-7-15(14-13-8)9-1-3-10(4-2-9)18(12,16)17/h1-4,7H,5-6H2,(H2,12,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Translocator protein (Rattus norvegicus (rat))	BDBM50232191 (CHEMBL4089611) Show SMILES CCC(CC)C(=O)Cc1c(nn2c(cc(C)nc12)-c1ccccc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C26H26ClN3O/c1-4-18(5-2)24(31)16-22-25(20-11-13-21(27)14-12-20)29-30-23(15-17(3)28-26(22)30)19-9-7-6-8-10-19/h6-15,18H,4-5,16H2,1-3H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]Ro5-4864 from PBZR in rat kidney mitochondrial membranes measured after 90 mins by liquid scintillation counting				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059072 (CHEMBL3326417) Show SMILES NS(=O)(=O)c1c(F)c(F)c(c(F)c1F)-n1cc(CO)nn1 Show InChI InChI=1S/C9H6F4N4O3S/c10-4-6(12)9(21(14,19)20)7(13)5(11)8(4)17-1-3(2-18)15-16-17/h1,18H,2H2,(H2,14,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Translocator protein (Rattus norvegicus (rat))	BDBM50232201 (CHEMBL4099753) Show SMILES CCC(CC)C(=O)Cc1c(nn2c(C)cc(nc12)-c1ccccc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C26H26ClN3O/c1-4-18(5-2)24(31)16-22-25(20-11-13-21(27)14-12-20)29-30-17(3)15-23(28-26(22)30)19-9-7-6-8-10-19/h6-15,18H,4-5,16H2,1-3H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]Ro5-4864 from PBZR in rat kidney mitochondrial membranes measured after 90 mins by liquid scintillation counting				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50058938 (CHEMBL3326419) Show SMILES NCc1cn(nn1)-c1c(F)c(F)c(c(F)c1F)S(N)(=O)=O Show InChI InChI=1S/C9H7F4N5O2S/c10-4-6(12)9(21(15,19)20)7(13)5(11)8(4)18-2-3(1-14)16-17-18/h2H,1,14H2,(H2,15,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM15233 (4-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]benzene...) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CO)nn1 Show InChI InChI=1S/C9H10N4O3S/c10-17(15,16)9-3-1-8(2-4-9)13-5-7(6-14)11-12-13/h1-5,14H,6H2,(H2,10,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50058937 (CHEMBL3326401) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(nn1)C1CCCCC1 Show InChI InChI=1S/C14H18N4O2S/c15-21(19,20)13-8-6-12(7-9-13)18-10-14(16-17-18)11-4-2-1-3-5-11/h6-11H,1-5H2,(H2,15,19,20)	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	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Translocator protein (Rattus norvegicus (rat))	BDBM50232190 (CHEMBL4061482) Show SMILES CCC(CC)C(=O)Cc1c(nn2c(C)cc(C)nc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C22H27N3O2/c1-6-16(7-2)20(26)13-19-21(17-8-10-18(27-5)11-9-17)24-25-15(4)12-14(3)23-22(19)25/h8-12,16H,6-7,13H2,1-5H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]Ro5-4864 from PBZR in rat kidney mitochondrial membranes measured after 90 mins by liquid scintillation counting				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059079 (CHEMBL3326408) Show SMILES NCc1cn(nn1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C9H11N5O2S/c10-5-7-6-14(13-12-7)8-1-3-9(4-2-8)17(11,15)16/h1-4,6H,5,10H2,(H2,11,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Translocator protein (Rattus norvegicus (rat))	BDBM50232201 (CHEMBL4099753) Show SMILES CCC(CC)C(=O)Cc1c(nn2c(C)cc(nc12)-c1ccccc1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C26H26ClN3O/c1-4-18(5-2)24(31)16-22-25(20-11-13-21(27)14-12-20)29-30-17(3)15-23(28-26(22)30)19-9-7-6-8-10-19/h6-15,18H,4-5,16H2,1-3H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from PBZR in rat kidney mitochondrial membranes measured after 90 mins by liquid scintillation counting				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50262063 (4-(4-p-tolyl-1H-1,2,3-triazol-1-yl)benzenesulfonam...) Show SMILES Cc1ccc(cc1)-c1cn(nn1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H14N4O2S/c1-11-2-4-12(5-3-11)15-10-19(18-17-15)13-6-8-14(9-7-13)22(16,20)21/h2-10H,1H3,(H2,16,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50058939 (CHEMBL3326418) Show SMILES CC(C)(C)OC(=O)NCc1cn(nn1)-c1c(F)c(F)c(c(F)c1F)S(N)(=O)=O Show InChI InChI=1S/C14H15F4N5O4S/c1-14(2,3)27-13(24)20-4-6-5-23(22-21-6)11-7(15)9(17)12(28(19,25)26)10(18)8(11)16/h5H,4H2,1-3H3,(H,20,24)(H2,19,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50059070 (CHEMBL3326415) Show SMILES NS(=O)(=O)c1c(F)c(F)c(c(F)c1F)-n1cc(CCCCCl)nn1 Show InChI InChI=1S/C12H11ClF4N4O2S/c13-4-2-1-3-6-5-21(20-19-6)11-7(14)9(16)12(24(18,22)23)10(17)8(11)15/h5H,1-4H2,(H2,18,22,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50059069 (CHEMBL3326414) Show SMILES NS(=O)(=O)c1c(F)c(F)c(c(F)c1F)-n1cc(CCCCl)nn1 Show InChI InChI=1S/C11H9ClF4N4O2S/c12-3-1-2-5-4-20(19-18-5)10-6(13)8(15)11(23(17,21)22)9(16)7(10)14/h4H,1-3H2,(H2,17,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Translocator protein (Rattus norvegicus (rat))	BDBM50232190 (CHEMBL4061482) Show SMILES CCC(CC)C(=O)Cc1c(nn2c(C)cc(C)nc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C22H27N3O2/c1-6-16(7-2)20(26)13-19-21(17-8-10-18(27-5)11-9-17)24-25-15(4)12-14(3)23-22(19)25/h8-12,16H,6-7,13H2,1-5H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from PBZR in rat kidney mitochondrial membranes measured after 90 mins by liquid scintillation counting				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50059073 (CHEMBL3326402) Show SMILES CCCCCc1ccc(cc1)-c1cn(nn1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C19H22N4O2S/c1-2-3-4-5-15-6-8-16(9-7-15)19-14-23(22-21-19)17-10-12-18(13-11-17)26(20,24)25/h6-14H,2-5H2,1H3,(H2,20,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Corticotropin-releasing factor receptor 1 (Homo sapiens (Human))	BDBM50232183 (CHEMBL4097805) Show SMILES CCCCN(CC)c1cc(C)nc2c(c(CCCC)nn12)-c1ccc(Cl)cc1Cl |(7.21,-2.04,;7.21,-3.58,;8.54,-4.35,;8.54,-5.89,;9.88,-6.66,;11.21,-5.89,;11.21,-4.35,;9.88,-8.2,;8.55,-8.98,;8.55,-10.52,;7.22,-11.29,;9.88,-11.28,;11.21,-10.52,;12.67,-10.99,;13.58,-9.75,;15.12,-9.75,;15.89,-11.08,;17.43,-11.08,;18.2,-12.41,;12.67,-8.5,;11.21,-8.98,;13.15,-12.46,;12.11,-13.59,;12.59,-15.06,;14.1,-15.38,;14.57,-16.84,;15.13,-14.23,;14.65,-12.77,;15.67,-11.62,)| Show InChI InChI=1S/C23H30Cl2N4/c1-5-8-10-20-22(18-12-11-17(24)15-19(18)25)23-26-16(4)14-21(29(23)27-20)28(7-3)13-9-6-2/h11-12,14-15H,5-10,13H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [125I]o-CRF from recombinant human CRF1 receptor expressed in CHO cells				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50059068 (CHEMBL3326413) Show SMILES NS(=O)(=O)c1c(F)c(F)c(c(F)c1F)-n1cc(CCBr)nn1 Show InChI InChI=1S/C10H7BrF4N4O2S/c11-2-1-4-3-19(18-17-4)9-5(12)7(14)10(22(16,20)21)8(15)6(9)13/h3H,1-2H2,(H2,16,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50059076 (CHEMBL3326405) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CCCCCl)nn1 Show InChI InChI=1S/C12H15ClN4O2S/c13-8-2-1-3-10-9-17(16-15-10)11-4-6-12(7-5-11)20(14,18)19/h4-7,9H,1-3,8H2,(H2,14,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50058940 (CHEMBL3326410) Show SMILES NS(=O)(=O)c1c(F)c(F)c(c(F)c1F)-n1cc(nn1)-c1ccccc1 Show InChI InChI=1S/C14H8F4N4O2S/c15-9-11(17)14(25(19,23)24)12(18)10(16)13(9)22-6-8(20-21-22)7-4-2-1-3-5-7/h1-6H,(H2,19,23,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	5.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					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
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair				3D Structure (crystal)
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	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of human CA12 using CO2 as substrate incubated for 6 hrs prior to substrate addition measured for 10 to 100 secs by stopped flow technique				Bioorg Med Chem Lett 22: 5801-6 (2012) Article DOI: 10.1016/j.bmcl.2012.07.094 BindingDB Entry DOI: 10.7270/Q2319X0G
					More data for this Ligand-Target Pair				3D Structure (crystal)
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	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 catalytic domain preincubated for 15 mins prior to testing measured for 10 to 100 secs by pheno...				ACS Med Chem Lett 8: 941-946 (2017) Article DOI: 10.1021/acsmedchemlett.7b00229 BindingDB Entry DOI: 10.7270/Q2ZK5K8P
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50262062 (4-(4-phenyl-1H-1,2,3-triazol-1-yl)benzenesulfonami...) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(nn1)-c1ccccc1 Show InChI InChI=1S/C14H12N4O2S/c15-21(19,20)13-8-6-12(7-9-13)18-10-14(16-17-18)11-4-2-1-3-5-11/h1-10H,(H2,15,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50059075 (CHEMBL3326404) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CCCCl)nn1 Show InChI InChI=1S/C11H13ClN4O2S/c12-7-1-2-9-8-16(15-14-9)10-3-5-11(6-4-10)19(13,17)18/h3-6,8H,1-2,7H2,(H2,13,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50059074 (CHEMBL3326403) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CCBr)nn1 Show InChI InChI=1S/C10H11BrN4O2S/c11-6-5-8-7-15(14-13-8)9-1-3-10(4-2-9)18(12,16)17/h1-4,7H,5-6H2,(H2,12,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1 (Rattus norvegicus (Rat))	BDBM50232200 (CHEMBL4081736) Show SMILES O=c1c(c[nH]c2c(cnn12)-c1ccccn1)-c1ccsc1 Show InChI InChI=1S/C15H10N4OS/c20-15-11(10-4-6-21-9-10)7-17-14-12(8-18-19(14)15)13-3-1-2-5-16-13/h1-9,17H	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]RO15-1788 from recombinant rat GABAalpha1 receptor expressed in HEK293 cells after 1 hr				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM15233 (4-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]benzene...) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CO)nn1 Show InChI InChI=1S/C9H10N4O3S/c10-17(15,16)9-3-1-8(2-4-9)13-5-7(6-14)11-12-13/h1-5,14H,6H2,(H2,10,15,16)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	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
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50058938 (CHEMBL3326419) Show SMILES NCc1cn(nn1)-c1c(F)c(F)c(c(F)c1F)S(N)(=O)=O Show InChI InChI=1S/C9H7F4N5O2S/c10-4-6(12)9(21(15,19)20)7(13)5(11)8(4)18-2-3(1-14)16-17-18/h2H,1,14H2,(H2,15,19,20)	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	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-5 (RAT)	BDBM50000766 (CHEMBL12 | DIAZEPAM | US9271961, Diazepam) Show SMILES CN1c2ccc(Cl)cc2C(=NCC1=O)c1ccccc1 |c:10| Show InChI InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of KwaZulu-Natal Curated by ChEMBL					Assay Description Displacement of [3H]RO15-1788 from recombinant rat GABAalpha5 receptor expressed in HEK293 cells after 1 hr				Eur J Med Chem 126: 298-352 (2017) Article DOI: 10.1016/j.ejmech.2016.11.019 BindingDB Entry DOI: 10.7270/Q2S184RN
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50059078 (CHEMBL3326407) Show SMILES CC(C)(C)OC(=O)NCc1cn(nn1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H19N5O4S/c1-14(2,3)23-13(20)16-8-10-9-19(18-17-10)11-4-6-12(7-5-11)24(15,21)22/h4-7,9H,8H2,1-3H3,(H,16,20)(H2,15,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 9 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50059067 (CHEMBL3326412) Show SMILES CCCCCc1ccc(cc1)-c1cn(nn1)-c1c(F)c(F)c(c(F)c1F)S(N)(=O)=O Show InChI InChI=1S/C19H18F4N4O2S/c1-2-3-4-5-11-6-8-12(9-7-11)13-10-27(26-25-13)18-14(20)16(22)19(30(24,28)29)17(23)15(18)21/h6-10H,2-5H2,1H3,(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	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 12 preincubated for 15 mins by stopped-flow CO2 hydrase Assay				ACS Med Chem Lett 5: 927-30 (2014) Article DOI: 10.1021/ml500196t BindingDB Entry DOI: 10.7270/Q2ZS2Z68
					More data for this Ligand-Target Pair

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