Compile Data Set for Download or QSAR

Found 96 hits with Last Name = 'amjad' and Initial = 'st'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50524779 (CHEMBL4447079) Show SMILES Fc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)-c1ccc2occc2c1 Show InChI InChI=1S/C20H13FO4S/c21-17-4-8-19(9-5-17)26(22,23)25-18-6-1-14(2-7-18)15-3-10-20-16(13-15)11-12-24-20/h1-13H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA-tagged carbonic anhydrase 2 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after 3...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524777 (CHEMBL4452931) Show SMILES O=S(=O)(Oc1ccc(cc1)-c1ccc2occc2c1)C1CCCCC1 Show InChI InChI=1S/C20H20O4S/c21-25(22,19-4-2-1-3-5-19)24-18-9-6-15(7-10-18)16-8-11-20-17(14-16)12-13-23-20/h6-14,19H,1-5H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524773 (CHEMBL4533978) Show SMILES CN(C)S(=O)(=O)Oc1ccc(cc1)-c1ccc2occc2c1 Show InChI InChI=1S/C16H15NO4S/c1-17(2)22(18,19)21-15-6-3-12(4-7-15)13-5-8-16-14(11-13)9-10-20-16/h3-11H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464734 (CHEMBL4284174) Show SMILES FC(F)(F)c1cc(=O)n2nc(sc2n1)-c1ccccc1 Show InChI InChI=1S/C12H6F3N3OS/c13-12(14,15)8-6-9(19)18-11(16-8)20-10(17-18)7-4-2-1-3-5-7/h1-6H	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464729 (CHEMBL4286917) Show SMILES FC(F)(F)Oc1ccc(cc1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C13H5F6N3O2S/c14-12(15,16)8-5-9(23)22-11(20-8)25-10(21-22)6-1-3-7(4-2-6)24-13(17,18)19/h1-5H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524780 (CHEMBL4540118) Show SMILES O=S(=O)(Oc1ccc(cc1)-c1ccc2sccc2c1)c1ccccc1 Show InChI InChI=1S/C20H14O3S2/c21-25(22,19-4-2-1-3-5-19)23-18-9-6-15(7-10-18)16-8-11-20-17(14-16)12-13-24-20/h1-14H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524779 (CHEMBL4447079) Show SMILES Fc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)-c1ccc2occc2c1 Show InChI InChI=1S/C20H13FO4S/c21-17-4-8-19(9-5-17)26(22,23)25-18-6-1-14(2-7-18)15-3-10-20-16(13-15)11-12-24-20/h1-13H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464736 (CHEMBL4291826) Show SMILES COc1ccc(cc1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C13H8F3N3O2S/c1-21-8-4-2-7(3-5-8)11-18-19-10(20)6-9(13(14,15)16)17-12(19)22-11/h2-6H,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464720 (CHEMBL4281930) Show SMILES FC(F)(F)c1cc(=O)n2nc(NCC=C)sc2n1 Show InChI InChI=1S/C9H7F3N4OS/c1-2-3-13-7-15-16-6(17)4-5(9(10,11)12)14-8(16)18-7/h2,4H,1,3H2,(H,13,15)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524768 (CHEMBL4469527) Show SMILES CCCS(=O)(=O)Oc1ccc(cc1)-c1ccc2sccc2c1 Show InChI InChI=1S/C17H16O3S2/c1-2-11-22(18,19)20-16-6-3-13(4-7-16)14-5-8-17-15(12-14)9-10-21-17/h3-10,12H,2,11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464732 (CHEMBL4292485) Show SMILES CCCNc1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C9H9F3N4OS/c1-2-3-13-7-15-16-6(17)4-5(9(10,11)12)14-8(16)18-7/h4H,2-3H2,1H3,(H,13,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50524768 (CHEMBL4469527) Show SMILES CCCS(=O)(=O)Oc1ccc(cc1)-c1ccc2sccc2c1 Show InChI InChI=1S/C17H16O3S2/c1-2-11-22(18,19)20-16-6-3-13(4-7-16)14-5-8-17-15(12-14)9-10-21-17/h3-10,12H,2,11H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA-tagged carbonic anhydrase 2 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after 3...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464719 (CHEMBL4289799) Show SMILES Nc1ccc(Nc2nn3c(nc(cc3=O)C(F)(F)F)s2)cc1 Show InChI InChI=1S/C12H8F3N5OS/c13-12(14,15)8-5-9(21)20-11(18-8)22-10(19-20)17-7-3-1-6(16)2-4-7/h1-5H,16H2,(H,17,19)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	330	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464717 (CHEMBL4292054) Show SMILES Cc1ccc(cc1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C13H8F3N3OS/c1-7-2-4-8(5-3-7)11-18-19-10(20)6-9(13(14,15)16)17-12(19)21-11/h2-6H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464716 (CHEMBL4283860) Show SMILES COc1cccc(Nc2nn3c(nc(cc3=O)C(F)(F)F)s2)c1 Show InChI InChI=1S/C13H9F3N4O2S/c1-22-8-4-2-3-7(5-8)17-11-19-20-10(21)6-9(13(14,15)16)18-12(20)23-11/h2-6H,1H3,(H,17,19)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50524770 (CHEMBL4554647) Show SMILES O=S(=O)(Oc1ccc(cc1)-c1ccc2occc2c1)c1ccccc1 Show InChI InChI=1S/C20H14O4S/c21-25(22,19-4-2-1-3-5-19)24-18-9-6-15(7-10-18)16-8-11-20-17(14-16)12-13-23-20/h1-14H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA-tagged carbonic anhydrase 2 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after 3...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464734 (CHEMBL4284174) Show SMILES FC(F)(F)c1cc(=O)n2nc(sc2n1)-c1ccccc1 Show InChI InChI=1S/C12H6F3N3OS/c13-12(14,15)8-6-9(19)18-11(16-8)20-10(17-18)7-4-2-1-3-5-7/h1-6H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464716 (CHEMBL4283860) Show SMILES COc1cccc(Nc2nn3c(nc(cc3=O)C(F)(F)F)s2)c1 Show InChI InChI=1S/C13H9F3N4O2S/c1-22-8-4-2-3-7(5-8)17-11-19-20-10(21)6-9(13(14,15)16)18-12(20)23-11/h2-6H,1H3,(H,17,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464739 (CHEMBL4285299) Show SMILES CN(C)CCNc1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C10H12F3N5OS/c1-17(2)4-3-14-8-16-18-7(19)5-6(10(11,12)13)15-9(18)20-8/h5H,3-4H2,1-2H3,(H,14,16)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464724 (CHEMBL4286723) Show SMILES Cc1cc(C)cc(c1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C14H10F3N3OS/c1-7-3-8(2)5-9(4-7)12-19-20-11(21)6-10(14(15,16)17)18-13(20)22-12/h3-6H,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	460	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464730 (CHEMBL4279537) Show SMILES [O-][N+](=O)c1cccc(c1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C12H5F3N4O3S/c13-12(14,15)8-5-9(20)18-11(16-8)23-10(17-18)6-2-1-3-7(4-6)19(21)22/h1-5H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464736 (CHEMBL4291826) Show SMILES COc1ccc(cc1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C13H8F3N3O2S/c1-21-8-4-2-7(3-5-8)11-18-19-10(20)6-9(13(14,15)16)17-12(19)22-11/h2-6H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524770 (CHEMBL4554647) Show SMILES O=S(=O)(Oc1ccc(cc1)-c1ccc2occc2c1)c1ccccc1 Show InChI InChI=1S/C20H14O4S/c21-25(22,19-4-2-1-3-5-19)24-18-9-6-15(7-10-18)16-8-11-20-17(14-16)12-13-23-20/h1-14H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	490	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50524771 (CHEMBL4517453) Show SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)-c1ccc2occc2c1 Show InChI InChI=1S/C21H16O4S/c1-15-2-9-20(10-3-15)26(22,23)25-19-7-4-16(5-8-19)17-6-11-21-18(14-17)12-13-24-21/h2-14H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA-tagged carbonic anhydrase 2 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after 3...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464724 (CHEMBL4286723) Show SMILES Cc1cc(C)cc(c1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C14H10F3N3OS/c1-7-3-8(2)5-9(4-7)12-19-20-11(21)6-10(14(15,16)17)18-13(20)22-12/h3-6H,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464741 (CHEMBL4294808) Show SMILES FC(F)(F)c1cccc(c1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C13H5F6N3OS/c14-12(15,16)7-3-1-2-6(4-7)10-21-22-9(23)5-8(13(17,18)19)20-11(22)24-10/h1-5H	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524769 (CHEMBL4592008) Show SMILES CS(=O)(=O)Oc1ccc(cc1)-c1ccc2occc2c1 Show InChI InChI=1S/C15H12O4S/c1-20(16,17)19-14-5-2-11(3-6-14)12-4-7-15-13(10-12)8-9-18-15/h2-10H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464735 (CHEMBL4281206) Show SMILES Cc1ccc(cc1C)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C14H10F3N3OS/c1-7-3-4-9(5-8(7)2)12-19-20-11(21)6-10(14(15,16)17)18-13(20)22-12/h3-6H,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464738 (CHEMBL4287459) Show SMILES FC(F)(F)c1cc(=O)n2nc(sc2n1)-c1cccc(c1)C#N Show InChI InChI=1S/C13H5F3N4OS/c14-13(15,16)9-5-10(21)20-12(18-9)22-11(19-20)8-3-1-2-7(4-8)6-17/h1-5H	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464721 (CHEMBL4277341) Show SMILES CCCCCNc1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C11H13F3N4OS/c1-2-3-4-5-15-9-17-18-8(19)6-7(11(12,13)14)16-10(18)20-9/h6H,2-5H2,1H3,(H,15,17)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464730 (CHEMBL4279537) Show SMILES [O-][N+](=O)c1cccc(c1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C12H5F3N4O3S/c13-12(14,15)8-5-9(20)18-11(16-8)23-10(17-18)6-2-1-3-7(4-6)19(21)22/h1-5H	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464741 (CHEMBL4294808) Show SMILES FC(F)(F)c1cccc(c1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C13H5F6N3OS/c14-12(15,16)7-3-1-2-6(4-7)10-21-22-9(23)5-8(13(17,18)19)20-11(22)24-10/h1-5H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464733 (CHEMBL4281863) Show SMILES CCCCNc1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C10H11F3N4OS/c1-2-3-4-14-8-16-17-7(18)5-6(10(11,12)13)15-9(17)19-8/h5H,2-4H2,1H3,(H,14,16)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464719 (CHEMBL4289799) Show SMILES Nc1ccc(Nc2nn3c(nc(cc3=O)C(F)(F)F)s2)cc1 Show InChI InChI=1S/C12H8F3N5OS/c13-12(14,15)8-5-9(21)20-11(18-8)22-10(19-20)17-7-3-1-6(16)2-4-7/h1-5H,16H2,(H,17,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464728 (CHEMBL4281616) Show SMILES Fc1cccc(c1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C12H5F4N3OS/c13-7-3-1-2-6(4-7)10-18-19-9(20)5-8(12(14,15)16)17-11(19)21-10/h1-5H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	740	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464725 (CHEMBL4288407) Show SMILES COc1cc(OC)cc(c1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C14H10F3N3O3S/c1-22-8-3-7(4-9(5-8)23-2)12-19-20-11(21)6-10(14(15,16)17)18-13(20)24-12/h3-6H,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	760	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464721 (CHEMBL4277341) Show SMILES CCCCCNc1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C11H13F3N4OS/c1-2-3-4-5-15-9-17-18-8(19)6-7(11(12,13)14)16-10(18)20-9/h6H,2-5H2,1H3,(H,15,17)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	760	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464726 (CHEMBL4292887) Show SMILES CCOc1ccc(cc1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C14H10F3N3O2S/c1-2-22-9-5-3-8(4-6-9)12-19-20-11(21)7-10(14(15,16)17)18-13(20)23-12/h3-7H,2H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	790	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524767 (CHEMBL4591628) Show SMILES CS(=O)(=O)Oc1ccc(cc1)-c1ccc2sccc2c1 Show InChI InChI=1S/C15H12O3S2/c1-20(16,17)18-14-5-2-11(3-6-14)12-4-7-15-13(10-12)8-9-19-15/h2-10H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	870	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464733 (CHEMBL4281863) Show SMILES CCCCNc1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C10H11F3N4OS/c1-2-3-4-14-8-16-17-7(18)5-6(10(11,12)13)15-9(17)19-8/h5H,2-4H2,1H3,(H,14,16)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	880	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464720 (CHEMBL4281930) Show SMILES FC(F)(F)c1cc(=O)n2nc(NCC=C)sc2n1 Show InChI InChI=1S/C9H7F3N4OS/c1-2-3-13-7-15-16-6(17)4-5(9(10,11)12)14-8(16)18-7/h2,4H,1,3H2,(H,13,15)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	890	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524784 (CHEMBL4576825) Show SMILES CCS(=O)(=O)Oc1ccc(cc1)-c1ccc2sccc2c1 Show InChI InChI=1S/C16H14O3S2/c1-2-21(17,18)19-15-6-3-12(4-7-15)13-5-8-16-14(11-13)9-10-20-16/h3-11H,2H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	920	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464726 (CHEMBL4292887) Show SMILES CCOc1ccc(cc1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C14H10F3N3O2S/c1-2-22-9-5-3-8(4-6-9)12-19-20-11(21)7-10(14(15,16)17)18-13(20)23-12/h3-7H,2H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	930	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524778 (CHEMBL4591260) Show SMILES O=S(=O)(Oc1ccc(cc1)-c1ccc2sccc2c1)C1CCCCC1 Show InChI InChI=1S/C20H20O3S2/c21-25(22,19-4-2-1-3-5-19)23-18-9-6-15(7-10-18)16-8-11-20-17(14-16)12-13-24-20/h6-14,19H,1-5H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	970	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50524772 (CHEMBL4557523) Show SMILES CNS(=O)(=O)Oc1ccc(cc1)-c1ccc2occc2c1 Show InChI InChI=1S/C15H13NO4S/c1-16-21(17,18)20-14-5-2-11(3-6-14)12-4-7-15-13(10-12)8-9-19-15/h2-10,16H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA-tagged carbonic anhydrase 2 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after 3...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464717 (CHEMBL4292054) Show SMILES Cc1ccc(cc1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C13H8F3N3OS/c1-7-2-4-8(5-3-7)11-18-19-10(20)6-9(13(14,15)16)17-12(19)21-11/h2-6H,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464740 (CHEMBL4284091) Show SMILES FC(F)(F)c1cc(=O)n2nc(sc2n1)-c1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C18H10F3N3OS/c19-18(20,21)14-10-15(25)24-17(22-14)26-16(23-24)13-8-4-7-12(9-13)11-5-2-1-3-6-11/h1-10H	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Homo sapiens (Human))	BDBM50464738 (CHEMBL4287459) Show SMILES FC(F)(F)c1cc(=O)n2nc(sc2n1)-c1cccc(c1)C#N Show InChI InChI=1S/C13H5F3N4OS/c14-13(15,16)9-5-10(21)20-12(18-9)22-11(19-20)8-3-1-2-7(4-8)6-17/h1-5H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.12E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human IAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by ...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50524771 (CHEMBL4517453) Show SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)-c1ccc2occc2c1 Show InChI InChI=1S/C21H16O4S/c1-15-2-9-20(10-3-15)26(22,23)25-19-7-4-16(5-8-19)17-6-11-21-18(14-17)12-13-24-21/h2-14H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.13E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Sharjah Curated by ChEMBL					Assay Description Inhibition of human recombinant N-HA--tagged carbonic anhydrase 12 expressed in HEK293T cells using p-nitrophenyl acetate as substrate measured after...				Bioorg Med Chem 27: 3889-3901 (2019) Article DOI: 10.1016/j.bmc.2019.07.026 BindingDB Entry DOI: 10.7270/Q2GX4G0K
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50464725 (CHEMBL4288407) Show SMILES COc1cc(OC)cc(c1)-c1nn2c(nc(cc2=O)C(F)(F)F)s1 Show InChI InChI=1S/C14H10F3N3O3S/c1-22-8-3-7(4-9(5-8)23-2)12-19-20-11(21)6-10(14(15,16)17)18-13(20)24-12/h3-6H,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£t Rostock Curated by ChEMBL					Assay Description Inhibition of human TNAP expressed in COS7 cells preincubated for 5 to 7 mins followed by CDP-star substrate addition measured after 15 to 20 mins by...				Eur J Med Chem 144: 116-127 (2018) Article DOI: 10.1016/j.ejmech.2017.11.068 BindingDB Entry DOI: 10.7270/Q2W66PDP
					More data for this Ligand-Target Pair

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