Compile Data Set for Download or QSAR

Found 37 hits with Last Name = 'yap' and Initial = 'a'   

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
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255003 (CHEMBL519613 | N-((R)-3-((S)-2-(1H-benzo[d]imidazo...) Show SMILES ON(C[C@@H](CC1CC1)C(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1)C=O |r| Show InChI InChI=1S/C19H24N4O3/c24-12-22(26)11-14(10-13-7-8-13)19(25)23-9-3-6-17(23)18-20-15-4-1-2-5-16(15)21-18/h1-2,4-5,12-14,17,26H,3,6-11H2,(H,20,21)/t14-,17+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (docked)
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255000 (CHEMBL443904 | N-((R)-2-((S)-2-(1H-benzo[d]imidazo...) Show SMILES CCCC[C@H](CN(O)C=O)C(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1 |r| Show InChI InChI=1S/C19H26N4O3/c1-2-3-7-14(12-22(26)13-24)19(25)23-11-6-10-17(23)18-20-15-8-4-5-9-16(15)21-18/h4-5,8-9,13-14,17,26H,2-3,6-7,10-12H2,1H3,(H,20,21)/t14-,17+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (docked)
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255030 (CHEMBL506649 | N-((R)-2-((S)-2-(benzo[d]oxazol-2-y...) Show SMILES CCCC[C@H](CN(O)C=O)C(=O)N1CCC[C@H]1c1nc2ccccc2o1 |r| Show InChI InChI=1S/C19H25N3O4/c1-2-3-7-14(12-21(25)13-23)19(24)22-11-6-9-16(22)18-20-15-8-4-5-10-17(15)26-18/h4-5,8,10,13-14,16,25H,2-3,6-7,9,11-12H2,1H3/t14-,16+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (crystal)
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255032 (CHEMBL465740 | N-((R)-2-((S)-2-(benzo[d]oxazol-2-y...) Show SMILES CCCCC[C@H](CN(O)C=O)C(=O)N1CCC[C@H]1c1nc2ccccc2o1 |r| Show InChI InChI=1S/C20H27N3O4/c1-2-3-4-8-15(13-22(26)14-24)20(25)23-12-7-10-17(23)19-21-16-9-5-6-11-18(16)27-19/h5-6,9,11,14-15,17,26H,2-4,7-8,10,12-13H2,1H3/t15-,17+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (docked)
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255002 (CHEMBL482180 | N-((R)-2-((S)-2-(1H-benzo[d]imidazo...) Show SMILES CCCCC[C@H](CN(O)C=O)C(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1 |r| Show InChI InChI=1S/C20H28N4O3/c1-2-3-4-8-15(13-23(27)14-25)20(26)24-12-7-11-18(24)19-21-16-9-5-6-10-17(16)22-19/h5-6,9-10,14-15,18,27H,2-4,7-8,11-13H2,1H3,(H,21,22)/t15-,18+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (docked)
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255065 ((S)-2-((S)-2-(1H-benzo[d]imidazol-2-yl)pyrrolidine...) Show SMILES CCCC[C@H](C(=O)NO)C(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1 |r| Show InChI InChI=1S/C18H24N4O3/c1-2-3-7-12(17(23)21-25)18(24)22-11-6-10-15(22)16-19-13-8-4-5-9-14(13)20-16/h4-5,8-9,12,15,25H,2-3,6-7,10-11H2,1H3,(H,19,20)(H,21,23)/t12-,15+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (docked)
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255033 (CHEMBL463859 | N-((R)-3-((S)-2-(benzo[d]oxazol-2-y...) Show SMILES ON(C[C@@H](CC1CC1)C(=O)N1CCC[C@H]1c1nc2ccccc2o1)C=O |r| Show InChI InChI=1S/C19H23N3O4/c23-12-21(25)11-14(10-13-7-8-13)19(24)22-9-3-5-16(22)18-20-15-4-1-2-6-17(15)26-18/h1-2,4,6,12-14,16,25H,3,5,7-11H2/t14-,16+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255001 (CHEMBL482179 | N-((R)-2-((S)-2-(1H-benzo[d]imidazo...) Show SMILES CCC[C@H](CN(O)C=O)C(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1 |r| Show InChI InChI=1S/C18H24N4O3/c1-2-6-13(11-21(25)12-23)18(24)22-10-5-9-16(22)17-19-14-7-3-4-8-15(14)20-17/h3-4,7-8,12-13,16,25H,2,5-6,9-11H2,1H3,(H,19,20)/t13-,16+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	24	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (docked)
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255031 (CHEMBL480220 | N-((R)-2-((S)-2-(benzo[d]oxazol-2-y...) Show SMILES CCC[C@H](CN(O)C=O)C(=O)N1CCC[C@H]1c1nc2ccccc2o1 |r| Show InChI InChI=1S/C18H23N3O4/c1-2-6-13(11-20(24)12-22)18(23)21-10-5-8-15(21)17-19-14-7-3-4-9-16(14)25-17/h3-4,7,9,12-13,15,24H,2,5-6,8,10-11H2,1H3/t13-,15+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (docked)
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255066 ((S)-2-((S)-2-(benzo[d]oxazol-2-yl)pyrrolidine-1-ca...) Show SMILES CCCC[C@H](C(=O)NO)C(=O)N1CCC[C@H]1c1nc2ccccc2o1 |r| Show InChI InChI=1S/C18H23N3O4/c1-2-3-7-12(16(22)20-24)18(23)21-11-6-9-14(21)17-19-13-8-4-5-10-15(13)25-17/h4-5,8,10,12,14,24H,2-3,6-7,9,11H2,1H3,(H,20,22)/t12-,14+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	49	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (docked)
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255004 (CHEMBL481391 | N-((R)-3-((S)-2-(1H-benzo[d]imidazo...) Show SMILES ON(C[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1)C=O |r| Show InChI InChI=1S/C22H24N4O3/c27-15-25(29)14-17(13-16-7-2-1-3-8-16)22(28)26-12-6-11-20(26)21-23-18-9-4-5-10-19(18)24-21/h1-5,7-10,15,17,20,29H,6,11-14H2,(H,23,24)/t17-,20+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255034 (CHEMBL518077 | N-((R)-3-((S)-2-(benzo[d]oxazol-2-y...) Show SMILES ON(C[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1c1nc2ccccc2o1)C=O |r| Show InChI InChI=1S/C22H23N3O4/c26-15-24(28)14-17(13-16-7-2-1-3-8-16)22(27)25-12-6-10-19(25)21-23-18-9-4-5-11-20(18)29-21/h1-5,7-9,11,15,17,19,28H,6,10,12-14H2/t17-,19+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	161	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (docked)
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255063 ((R)-3-((S)-2-(1H-benzo[d]imidazol-2-yl)pyrrolidine...) Show SMILES CCCC[C@H](CC(O)=O)C(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1 |r| Show InChI InChI=1S/C19H25N3O3/c1-2-3-7-13(12-17(23)24)19(25)22-11-6-10-16(22)18-20-14-8-4-5-9-15(14)21-18/h4-5,8-9,13,16H,2-3,6-7,10-12H2,1H3,(H,20,21)(H,23,24)/t13-,16+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	202	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair
Peptide deformylase (Mycobacterium tuberculosis)	BDBM50255064 ((R)-3-((S)-2-(benzo[d]oxazol-2-yl)pyrrolidine-1-ca...) Show SMILES CCCC[C@H](CC(O)=O)C(=O)N1CCC[C@H]1c1nc2ccccc2o1 |r| Show InChI InChI=1S/C19H24N2O4/c1-2-3-7-13(12-17(22)23)19(24)21-11-6-9-15(21)18-20-14-8-4-5-10-16(14)25-18/h4-5,8,10,13,15H,2-3,6-7,9,11-12H2,1H3,(H,22,23)/t13-,15+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	803	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Institute for Tropical Diseases Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis peptide deformylase expressed in Escherichia coli M15(pREp4) by microplate assay				Bioorg Med Chem Lett 18: 6568-72 (2008) Article DOI: 10.1016/j.bmcl.2008.10.040 BindingDB Entry DOI: 10.7270/Q2VX0GCD
					More data for this Ligand-Target Pair				3D Structure (docked)
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269103 (CHEMBL4070295) Show SMILES Clc1ccc(cc1)C1=NN(C(C1)c1cccc(Cl)c1Cl)c1ccccc1 |t:8| Show InChI InChI=1S/C21H15Cl3N2/c22-15-11-9-14(10-12-15)19-13-20(17-7-4-8-18(23)21(17)24)26(25-19)16-5-2-1-3-6-16/h1-12,20H,13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50243030 (CHEMBL4087976) Show SMILES COc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1ccco1 |c:11| Show InChI InChI=1S/C20H17NO2S/c1-22-15-10-8-14(9-11-15)20-13-17(18-6-4-12-23-18)21-16-5-2-3-7-19(16)24-20/h2-12,20H,13H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii sPLA2 pre-incubated for 5 mins before DMPC substrate addition and measured after 45 mins				Bioorg Med Chem Lett 27: 3048-3054 (2017) Article DOI: 10.1016/j.bmcl.2017.05.059 BindingDB Entry DOI: 10.7270/Q26Q20PF
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269094 (CHEMBL4080932) Show SMILES Fc1ccc(cc1)C1=NN(C(C1)c1cccc(Cl)c1Cl)c1ccccc1 |t:8| Show InChI InChI=1S/C21H15Cl2FN2/c22-18-8-4-7-17(21(18)23)20-13-19(14-9-11-15(24)12-10-14)25-26(20)16-5-2-1-3-6-16/h1-12,20H,13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269106 (CHEMBL4095047) Show SMILES COc1ccc(cc1)C1=NN(C(C1)c1cccc(Cl)c1Cl)c1ccccc1 |t:9| Show InChI InChI=1S/C22H18Cl2N2O/c1-27-17-12-10-15(11-13-17)20-14-21(18-8-5-9-19(23)22(18)24)26(25-20)16-6-3-2-4-7-16/h2-13,21H,14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50243033 (CHEMBL4092288) Show SMILES C1C(Sc2ccccc2N=C1c1ccco1)c1ccccc1 |c:10| Show InChI InChI=1S/C19H15NOS/c1-2-7-14(8-3-1)19-13-16(17-10-6-12-21-17)20-15-9-4-5-11-18(15)22-19/h1-12,19H,13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii sPLA2 pre-incubated for 5 mins before DMPC substrate addition and measured after 45 mins				Bioorg Med Chem Lett 27: 3048-3054 (2017) Article DOI: 10.1016/j.bmcl.2017.05.059 BindingDB Entry DOI: 10.7270/Q26Q20PF
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269092 (CHEMBL4088814) Show SMILES Clc1cccc(C2CC(=NN2c2ccccc2)c2ccccc2)c1Cl |c:8| Show InChI InChI=1S/C21H16Cl2N2/c22-18-13-7-12-17(21(18)23)20-14-19(15-8-3-1-4-9-15)24-25(20)16-10-5-2-6-11-16/h1-13,20H,14H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269104 (CHEMBL4089745) Show SMILES Clc1ccc(cc1)C1=NN(C(C1)c1cccc(Cl)c1Cl)c1cccc(Cl)c1 |t:8| Show InChI InChI=1S/C21H14Cl4N2/c22-14-9-7-13(8-10-14)19-12-20(17-5-2-6-18(24)21(17)25)27(26-19)16-4-1-3-15(23)11-16/h1-11,20H,12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.46E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269102 (CHEMBL4097473) Show SMILES Fc1ccc(cc1)C1=NN(C(C1)c1cccc(Cl)c1Cl)c1cccc(Cl)c1 |t:8| Show InChI InChI=1S/C21H14Cl3FN2/c22-14-3-1-4-16(11-14)27-20(17-5-2-6-18(23)21(17)24)12-19(26-27)13-7-9-15(25)10-8-13/h1-11,20H,12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50243036 (CHEMBL4071495) Show SMILES Clc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1ccco1 |c:10| Show InChI InChI=1S/C19H14ClNOS/c20-14-9-7-13(8-10-14)19-12-16(17-5-3-11-22-17)21-15-4-1-2-6-18(15)23-19/h1-11,19H,12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.93E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii sPLA2 pre-incubated for 5 mins before DMPC substrate addition and measured after 45 mins				Bioorg Med Chem Lett 27: 3048-3054 (2017) Article DOI: 10.1016/j.bmcl.2017.05.059 BindingDB Entry DOI: 10.7270/Q26Q20PF
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269093 (CHEMBL4105178) Show SMILES Clc1cccc(c1)N1N=C(CC1c1cccc(Cl)c1Cl)c1ccccc1 |c:9| Show InChI InChI=1S/C21H15Cl3N2/c22-15-8-4-9-16(12-15)26-20(17-10-5-11-18(23)21(17)24)13-19(25-26)14-6-2-1-3-7-14/h1-12,20H,13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.93E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50243030 (CHEMBL4087976) Show SMILES COc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1ccco1 |c:11| Show InChI InChI=1S/C20H17NO2S/c1-22-15-10-8-14(9-11-15)20-13-17(18-6-4-12-23-18)21-16-5-2-3-7-19(16)24-20/h2-12,20H,13H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.13E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2-induced hemolytic activity in human erythrocytes assessed as reduction hemoglobin release in presence of eg...				Bioorg Med Chem Lett 27: 3048-3054 (2017) Article DOI: 10.1016/j.bmcl.2017.05.059 BindingDB Entry DOI: 10.7270/Q26Q20PF
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269105 (CHEMBL4061627) Show SMILES Cc1ccc(cc1)C1=NN(C(C1)c1cccc(Cl)c1Cl)c1ccccc1 |t:8| Show InChI InChI=1S/C22H18Cl2N2/c1-15-10-12-16(13-11-15)20-14-21(18-8-5-9-19(23)22(18)24)26(25-20)17-6-3-2-4-7-17/h2-13,21H,14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.17E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50242996 (CHEMBL4062876) Show SMILES Brc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1ccco1 |c:10| Show InChI InChI=1S/C19H14BrNOS/c20-14-9-7-13(8-10-14)19-12-16(17-5-3-11-22-17)21-15-4-1-2-6-18(15)23-19/h1-11,19H,12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii sPLA2 pre-incubated for 5 mins before DMPC substrate addition and measured after 45 mins				Bioorg Med Chem Lett 27: 3048-3054 (2017) Article DOI: 10.1016/j.bmcl.2017.05.059 BindingDB Entry DOI: 10.7270/Q26Q20PF
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50243031 (CHEMBL4064024) Show SMILES C1Oc2ccc(cc2O1)C1CC(=Nc2ccccc2S1)c1ccco1 |c:13| Show InChI InChI=1S/C20H15NO3S/c1-2-6-19-14(4-1)21-15(16-5-3-9-22-16)11-20(25-19)13-7-8-17-18(10-13)24-12-23-17/h1-10,20H,11-12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii sPLA2 pre-incubated for 5 mins before DMPC substrate addition and measured after 45 mins				Bioorg Med Chem Lett 27: 3048-3054 (2017) Article DOI: 10.1016/j.bmcl.2017.05.059 BindingDB Entry DOI: 10.7270/Q26Q20PF
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50243035 (CHEMBL1570896) Show SMILES Fc1ccc(cc1)C1CC(=Nc2ccccc2S1)c1ccco1 |c:10| Show InChI InChI=1S/C19H14FNOS/c20-14-9-7-13(8-10-14)19-12-16(17-5-3-11-22-17)21-15-4-1-2-6-18(15)23-19/h1-11,19H,12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii sPLA2 pre-incubated for 5 mins before DMPC substrate addition and measured after 45 mins				Bioorg Med Chem Lett 27: 3048-3054 (2017) Article DOI: 10.1016/j.bmcl.2017.05.059 BindingDB Entry DOI: 10.7270/Q26Q20PF
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269107 (CHEMBL4074584) Show SMILES COc1cccc(c1)C1=NN(C(C1)c1cccc(Cl)c1Cl)c1ccccc1 |t:9| Show InChI InChI=1S/C22H18Cl2N2O/c1-27-17-10-5-7-15(13-17)20-14-21(18-11-6-12-19(23)22(18)24)26(25-20)16-8-3-2-4-9-16/h2-13,21H,14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.98E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269108 (CHEMBL4102805) Show SMILES COc1cccc(c1)C1=NN(C(C1)c1cccc(Cl)c1Cl)c1cccc(Cl)c1 |t:9| Show InChI InChI=1S/C22H17Cl3N2O/c1-28-17-8-2-5-14(11-17)20-13-21(18-9-4-10-19(24)22(18)25)27(26-20)16-7-3-6-15(23)12-16/h2-12,21H,13H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269109 (CHEMBL4084853) Show SMILES COc1ccccc1C1=NN(C(C1)c1cccc(Cl)c1Cl)c1ccccc1 |t:9| Show InChI InChI=1S/C22H18Cl2N2O/c1-27-21-13-6-5-10-16(21)19-14-20(17-11-7-12-18(23)22(17)24)26(25-19)15-8-3-2-4-9-15/h2-13,20H,14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269095 (CHEMBL4079484) Show SMILES COc1ccccc1C1=NN(C(C1)c1cccc(Cl)c1Cl)c1cccc(Cl)c1 |t:9| Show InChI InChI=1S/C22H17Cl3N2O/c1-28-21-11-3-2-8-16(21)19-13-20(17-9-5-10-18(24)22(17)25)27(26-19)15-7-4-6-14(23)12-15/h2-12,20H,13H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50243032 (CHEMBL4102457) Show SMILES COc1cc(ccc1O)C1CC(=Nc2ccccc2S1)c1ccco1 |c:12| Show InChI InChI=1S/C20H17NO3S/c1-23-18-11-13(8-9-16(18)22)20-12-15(17-6-4-10-24-17)21-14-5-2-3-7-19(14)25-20/h2-11,20,22H,12H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii sPLA2 pre-incubated for 5 mins before DMPC substrate addition and measured after 45 mins				Bioorg Med Chem Lett 27: 3048-3054 (2017) Article DOI: 10.1016/j.bmcl.2017.05.059 BindingDB Entry DOI: 10.7270/Q26Q20PF
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269101 (CHEMBL4103730) Show SMILES Clc1cccc(C2CC(=NN2c2ccccc2)c2ccc3OCOc3c2)c1Cl |c:8| Show InChI InChI=1S/C22H16Cl2N2O2/c23-17-8-4-7-16(22(17)24)19-12-18(25-26(19)15-5-2-1-3-6-15)14-9-10-20-21(11-14)28-13-27-20/h1-11,19H,12-13H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.82E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50269115 (CHEMBL4087360) Show SMILES Clc1cccc(c1)N1N=C(CC1c1cccc(Cl)c1Cl)c1ccc2OCOc2c1 |c:9| Show InChI InChI=1S/C22H15Cl3N2O2/c23-14-3-1-4-15(10-14)27-19(16-5-2-6-17(24)22(16)25)11-18(26-27)13-7-8-20-21(9-13)29-12-28-20/h1-10,19H,11-12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.98E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii venom sPLA2 using DMPC as substrate preincubated for 2 mins followed by substrate addition measured after 30 mins				Bioorg Med Chem Lett 27: 3806-3811 (2017) Article DOI: 10.1016/j.bmcl.2017.06.063 BindingDB Entry DOI: 10.7270/Q2W37ZTQ
					More data for this Ligand-Target Pair
Basic phospholipase A2 VRV-PL-VIIIa (Daboia russelii)	BDBM50243037 (CHEMBL4066680) Show SMILES [O-][N+](=O)c1ccc(cc1)C1CC(=Nc2ccccc2S1)c1ccco1 |c:12| Show InChI InChI=1S/C19H14N2O3S/c22-21(23)14-9-7-13(8-10-14)19-12-16(17-5-3-11-24-17)20-15-4-1-2-6-18(15)25-19/h1-11,19H,12H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.69E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of Vipera russelii sPLA2 pre-incubated for 5 mins before DMPC substrate addition and measured after 45 mins				Bioorg Med Chem Lett 27: 3048-3054 (2017) Article DOI: 10.1016/j.bmcl.2017.05.059 BindingDB Entry DOI: 10.7270/Q26Q20PF
					More data for this Ligand-Target Pair