Compile Data Set for Download or QSAR

Found 31 hits with Last Name = 'saify' and Initial = 'zs'   

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
Tyrosinase (Homo sapiens (Human))	BDBM50218211 (1'-(4-Methyl-benzyl)-[1,4']bipiperidinyl | CHEMBL3...) Show SMILES Cc1ccc(CN2CCC(CC2)N2CCCCC2)cc1 Show InChI InChI=1S/C18H28N2/c1-16-5-7-17(8-6-16)15-19-13-9-18(10-14-19)20-11-3-2-4-12-20/h5-8,18H,2-4,9-15H2,1H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.72E+3	n/a	n/a	n/a	n/a	6.8	37
University of Karachi					Assay Description Tyrosinase inhibition assays were performed in a 96-well microplate format using SpectraMax 340 (Molecular Devices, CA, USA) microplate reader accord...				J Enzyme Inhib Med Chem 20: 401-7 (2005) Article DOI: 10.1080/14756360500179333 BindingDB Entry DOI: 10.7270/Q29G5KBN
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362536 (CHEMBL1941013) Show SMILES O=C(Cn1c(nc2ccccc12)-c1ccccn1)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C26H19N3O/c30-25(21-15-13-20(14-16-21)19-8-2-1-3-9-19)18-29-24-12-5-4-10-22(24)28-26(29)23-11-6-7-17-27-23/h1-17H,18H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM50198715 ((2S)-2-amino-3-(3-hydroxy-4-oxopyridin-1(4H)-yl)pr...) Show SMILES N[C@@H](Cn1ccc(=O)c(O)c1)C(O)=O Show InChI InChI=1S/C8H10N2O4/c9-5(8(13)14)3-10-2-1-6(11)7(12)4-10/h1-2,4-5,12H,3,9H2,(H,13,14)/t5-/m0/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	3.68E+3	n/a	n/a	n/a	n/a	6.8	37
University of Karachi					Assay Description Tyrosinase inhibition assays were performed in a 96-well microplate format using SpectraMax 340 (Molecular Devices, CA, USA) microplate reader accord...				J Enzyme Inhib Med Chem 20: 401-7 (2005) Article DOI: 10.1080/14756360500179333 BindingDB Entry DOI: 10.7270/Q29G5KBN
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM50218209 (CHEMBL250773 | Tyrosinase Inhibitor, 3 | naphthale...) Show SMILES O=C(N1CCC(CC1)N1CCCCC1)c1ccc2ccccc2c1 Show InChI InChI=1S/C21H26N2O/c24-21(19-9-8-17-6-2-3-7-18(17)16-19)23-14-10-20(11-15-23)22-12-4-1-5-13-22/h2-3,6-9,16,20H,1,4-5,10-15H2	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.64E+3	n/a	n/a	n/a	n/a	6.8	37
University of Karachi					Assay Description Tyrosinase inhibition assays were performed in a 96-well microplate format using SpectraMax 340 (Molecular Devices, CA, USA) microplate reader accord...				J Enzyme Inhib Med Chem 20: 401-7 (2005) Article DOI: 10.1080/14756360500179333 BindingDB Entry DOI: 10.7270/Q29G5KBN
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM85773 (Tyrosinase Inhibitor, 8) Show SMILES O=N(=O)c1ccc(cc1)S(=O)(=O)N1CCC(CC1)N1CCCCC1 Show InChI InChI=1S/C16H23N3O4S/c20-19(21)15-4-6-16(7-5-15)24(22,23)18-12-8-14(9-13-18)17-10-2-1-3-11-17/h4-7,14H,1-3,8-13H2	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.76E+3	n/a	n/a	n/a	n/a	6.8	37
University of Karachi					Assay Description Tyrosinase inhibition assays were performed in a 96-well microplate format using SpectraMax 340 (Molecular Devices, CA, USA) microplate reader accord...				J Enzyme Inhib Med Chem 20: 401-7 (2005) Article DOI: 10.1080/14756360500179333 BindingDB Entry DOI: 10.7270/Q29G5KBN
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362533 (CHEMBL1941010) Show SMILES Fc1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H14FN3O/c21-15-10-8-14(9-11-15)19(25)13-24-18-7-2-1-5-16(18)23-20(24)17-6-3-4-12-22-17/h1-12H,13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362535 (CHEMBL1941012) Show SMILES O=C(Cn1c(nc2ccccc12)-c1ccccn1)c1ccccc1 Show InChI InChI=1S/C20H15N3O/c24-19(15-8-2-1-3-9-15)14-23-18-12-5-4-10-16(18)22-20(23)17-11-6-7-13-21-17/h1-13H,14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362537 (CHEMBL1941014) Show SMILES COc1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C21H17N3O2/c1-26-16-11-9-15(10-12-16)20(25)14-24-19-8-3-2-6-17(19)23-21(24)18-7-4-5-13-22-18/h2-13H,14H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362536 (CHEMBL1941013) Show SMILES O=C(Cn1c(nc2ccccc12)-c1ccccn1)c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C26H19N3O/c30-25(21-15-13-20(14-16-21)19-8-2-1-3-9-19)18-29-24-12-5-4-10-22(24)28-26(29)23-11-6-7-17-27-23/h1-17H,18H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.47E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM50031467 (5-HYDROXY-2-(HYDROXYMETHYL)-4H-PYRAN-4-ONE | 5-Hyd...) Show SMILES OCc1cc(=O)c(O)co1 Show InChI InChI=1S/C6H6O4/c7-2-4-1-5(8)6(9)3-10-4/h1,3,7,9H,2H2	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.67E+4	n/a	n/a	n/a	n/a	6.8	37
University of Karachi					Assay Description Tyrosinase inhibition assays were performed in a 96-well microplate format using SpectraMax 340 (Molecular Devices, CA, USA) microplate reader accord...				J Enzyme Inhib Med Chem 20: 401-7 (2005) Article DOI: 10.1080/14756360500179333 BindingDB Entry DOI: 10.7270/Q29G5KBN
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362532 (CHEMBL1941009) Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H14N4O3/c25-19(14-8-10-15(11-9-14)24(26)27)13-23-18-7-2-1-5-16(18)22-20(23)17-6-3-4-12-21-17/h1-12H,13H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.78E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM50218210 (2,2,2-trifluoro-1-(4-(piperidin-1-yl)piperidin-1-y...) Show SMILES FC(F)(F)C(=O)N1CCC(CC1)N1CCCCC1 Show InChI InChI=1S/C12H19F3N2O/c13-12(14,15)11(18)17-8-4-10(5-9-17)16-6-2-1-3-7-16/h10H,1-9H2	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.81E+4	n/a	n/a	n/a	n/a	6.8	37
University of Karachi					Assay Description Tyrosinase inhibition assays were performed in a 96-well microplate format using SpectraMax 340 (Molecular Devices, CA, USA) microplate reader accord...				J Enzyme Inhib Med Chem 20: 401-7 (2005) Article DOI: 10.1080/14756360500179333 BindingDB Entry DOI: 10.7270/Q29G5KBN
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM85774 (Tyrosinase Inhibitor, 10) Show SMILES C(CCN1CCC(CC1)N1CCCCC1)COc1ccccc1 Show InChI InChI=1S/C20H32N2O/c1-3-9-20(10-4-1)23-18-8-7-13-21-16-11-19(12-17-21)22-14-5-2-6-15-22/h1,3-4,9-10,19H,2,5-8,11-18H2	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.95E+4	n/a	n/a	n/a	n/a	6.8	37
University of Karachi					Assay Description Tyrosinase inhibition assays were performed in a 96-well microplate format using SpectraMax 340 (Molecular Devices, CA, USA) microplate reader accord...				J Enzyme Inhib Med Chem 20: 401-7 (2005) Article DOI: 10.1080/14756360500179333 BindingDB Entry DOI: 10.7270/Q29G5KBN
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362529 (CHEMBL1941006) Show SMILES Oc1ccc(cc1O)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H15N3O3/c24-17-9-8-13(11-18(17)25)19(26)12-23-16-7-2-1-5-14(16)22-20(23)15-6-3-4-10-21-15/h1-11,24-25H,12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362528 (CHEMBL1941005) Show SMILES [O-][N+](=O)c1cccc(c1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H14N4O3/c25-19(14-6-5-7-15(12-14)24(26)27)13-23-18-10-2-1-8-16(18)22-20(23)17-9-3-4-11-21-17/h1-12H,13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362528 (CHEMBL1941005) Show SMILES [O-][N+](=O)c1cccc(c1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H14N4O3/c25-19(14-6-5-7-15(12-14)24(26)27)13-23-18-10-2-1-8-16(18)22-20(23)17-9-3-4-11-21-17/h1-12H,13H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362538 (CHEMBL1941015) Show SMILES COc1ccc(OC)c(c1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C22H19N3O3/c1-27-15-10-11-21(28-2)16(13-15)20(26)14-25-19-9-4-3-7-17(19)24-22(25)18-8-5-6-12-23-18/h3-13H,14H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362530 (CHEMBL1941007) Show SMILES Clc1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H14ClN3O/c21-15-10-8-14(9-11-15)19(25)13-24-18-7-2-1-5-16(18)23-20(24)17-6-3-4-12-22-17/h1-12H,13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362529 (CHEMBL1941006) Show SMILES Oc1ccc(cc1O)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H15N3O3/c24-17-9-8-13(11-18(17)25)19(26)12-23-16-7-2-1-5-14(16)22-20(23)15-6-3-4-10-21-15/h1-11,24-25H,12H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.85E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM50218205 (1-(4-(piperidin-1-yl)piperidin-1-yl)ethanone | CHE...) Show SMILES CC(=O)N1CCC(CC1)N1CCCCC1 Show InChI InChI=1S/C12H22N2O/c1-11(15)13-9-5-12(6-10-13)14-7-3-2-4-8-14/h12H,2-10H2,1H3	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	2.99E+4	n/a	n/a	n/a	n/a	6.8	37
University of Karachi					Assay Description Tyrosinase inhibition assays were performed in a 96-well microplate format using SpectraMax 340 (Molecular Devices, CA, USA) microplate reader accord...				J Enzyme Inhib Med Chem 20: 401-7 (2005) Article DOI: 10.1080/14756360500179333 BindingDB Entry DOI: 10.7270/Q29G5KBN
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362532 (CHEMBL1941009) Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H14N4O3/c25-19(14-8-10-15(11-9-14)24(26)27)13-23-18-7-2-1-5-16(18)22-20(23)17-6-3-4-12-21-17/h1-12H,13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.05E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362531 (CHEMBL1941008) Show SMILES [O-][N+](=O)c1ccccc1C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H14N4O3/c25-19(14-7-1-3-10-17(14)24(26)27)13-23-18-11-4-2-8-15(18)22-20(23)16-9-5-6-12-21-16/h1-12H,13H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362530 (CHEMBL1941007) Show SMILES Clc1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H14ClN3O/c21-15-10-8-14(9-11-15)19(25)13-24-18-7-2-1-5-16(18)23-20(24)17-6-3-4-12-22-17/h1-12H,13H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362533 (CHEMBL1941010) Show SMILES Fc1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H14FN3O/c21-15-10-8-14(9-11-15)19(25)13-24-18-7-2-1-5-16(18)23-20(24)17-6-3-4-12-22-17/h1-12H,13H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362538 (CHEMBL1941015) Show SMILES COc1ccc(OC)c(c1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C22H19N3O3/c1-27-15-10-11-21(28-2)16(13-15)20(26)14-25-19-9-4-3-7-17(19)24-22(25)18-8-5-6-12-23-18/h3-13H,14H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362537 (CHEMBL1941014) Show SMILES COc1ccc(cc1)C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C21H17N3O2/c1-26-16-11-9-15(10-12-16)20(25)14-24-19-8-3-2-6-17(19)23-21(24)18-7-4-5-13-22-18/h2-13H,14H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362535 (CHEMBL1941012) Show SMILES O=C(Cn1c(nc2ccccc12)-c1ccccn1)c1ccccc1 Show InChI InChI=1S/C20H15N3O/c24-19(15-8-2-1-3-9-15)14-23-18-12-5-4-10-16(18)22-20(23)17-11-6-7-13-21-17/h1-13H,14H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362531 (CHEMBL1941008) Show SMILES [O-][N+](=O)c1ccccc1C(=O)Cn1c(nc2ccccc12)-c1ccccn1 Show InChI InChI=1S/C20H14N4O3/c25-19(14-7-1-3-10-17(14)24(26)27)13-23-18-11-4-2-8-15(18)22-20(23)16-9-5-6-12-21-16/h1-12H,13H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM50362534 (CHEMBL1941011) Show SMILES Fc1ccc(C(=O)Cn2c(nc3ccccc23)-c2ccccn2)c(F)c1 Show InChI InChI=1S/C20H13F2N3O/c21-13-8-9-14(15(22)11-13)19(26)12-25-18-7-2-1-5-16(18)24-20(25)17-6-3-4-10-23-17/h1-11H,12H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.45E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of human cathepsin D using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Plasmepsin II (Plasmodium falciparum)	BDBM50362534 (CHEMBL1941011) Show SMILES Fc1ccc(C(=O)Cn2c(nc3ccccc23)-c2ccccn2)c(F)c1 Show InChI InChI=1S/C20H13F2N3O/c21-13-8-9-14(15(22)11-13)19(26)12-25-18-7-2-1-5-16(18)24-20(25)17-6-3-4-10-23-17/h1-11H,12H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Karachi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum plasmepsin-2 using DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS as substrate by FRET analysis				Bioorg Med Chem Lett 22: 1282-6 (2012) Article DOI: 10.1016/j.bmcl.2011.10.018 BindingDB Entry DOI: 10.7270/Q2WS8TPJ
					More data for this Ligand-Target Pair
Tyrosinase (Homo sapiens (Human))	BDBM50218206 (1,4'-bipiperidine | 1,4'-bipiperidyl | 4-PIPERIDIN...) Show SMILES C1CCN(CC1)C1CCNCC1 Show InChI InChI=1S/C10H20N2/c1-2-8-12(9-3-1)10-4-6-11-7-5-10/h10-11H,1-9H2	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.11E+5	n/a	n/a	n/a	n/a	6.8	37
University of Karachi					Assay Description Tyrosinase inhibition assays were performed in a 96-well microplate format using SpectraMax 340 (Molecular Devices, CA, USA) microplate reader accord...				J Enzyme Inhib Med Chem 20: 401-7 (2005) Article DOI: 10.1080/14756360500179333 BindingDB Entry DOI: 10.7270/Q29G5KBN
					More data for this Ligand-Target Pair