Compile Data Set for Download or QSAR

Found 66 hits with Last Name = 'shantharam' and Initial = 'cs'   

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
Alpha-galactosidase (Coffea arabica (Coffee beans))	BDBM50520994 (CHEMBL4529797) Show SMILES OC[C@H]1NC[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O |r| Show InChI InChI=1S/C7H15NO5/c9-2-3-5(11)7(13)6(12)4(10)1-8-3/h3-13H,1-2H2/t3-,4+,5-,6+,7+/m1/s1	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of green coffee bean alpha-galactosidase				Eur J Med Chem 162: 465-494 (2019) Article DOI: 10.1016/j.ejmech.2018.11.031 BindingDB Entry DOI: 10.7270/Q2154MGW
					More data for this Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha (Homo sapiens (Human))	BDBM50520989 (CHEMBL4565280) Show SMILES CCC1CCCN(C)C(=O)[C+]1c1cccc(Oc2cc(ccc2C#N)C(C)(N)c2cncn2C)c1 Show InChI InChI=1S/C28H32N5O2/c1-5-19-9-7-13-32(3)27(34)26(19)20-8-6-10-23(14-20)35-24-15-22(12-11-21(24)16-29)28(2,30)25-17-31-18-33(25)4/h6,8,10-12,14-15,17-19H,5,7,9,13,30H2,1-4H3/q+1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.0600	n/a	n/a	n/a	n/a	n/a	n/a
wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of human recombinant FTase using [3H]FPP as substrate after 15 mins by scintillation counting analysis				Eur J Med Chem 162: 465-494 (2019) Article DOI: 10.1016/j.ejmech.2018.11.031 BindingDB Entry DOI: 10.7270/Q2154MGW
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM11823 (Azepane Derivative 4 | N-((3R,4R)-4-{[4-(2-fluoro-...) Show SMILES COc1ccc(O)c(C(=O)c2ccc(cc2)C(=O)N[C@@H]2CCCNC[C@H]2NC(=O)c2ccncc2)c1F |r| Show InChI InChI=1S/C27H27FN4O5/c1-37-22-9-8-21(33)23(24(22)28)25(34)16-4-6-17(7-5-16)26(35)31-19-3-2-12-30-15-20(19)32-27(36)18-10-13-29-14-11-18/h4-11,13-14,19-20,30,33H,2-3,12,15H2,1H3,(H,31,35)(H,32,36)/t19-,20-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of PKBalpha (unknown origin) expressed in Sf9 insect cells using Biotin-SGRARTSSFAEPG as substrate after 30 mins by ELISA				Eur J Med Chem 162: 465-494 (2019) Article DOI: 10.1016/j.ejmech.2018.11.031 BindingDB Entry DOI: 10.7270/Q2154MGW
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50002692 ((AZT) 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-...) Show SMILES Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)c(=O)[nH]c1=O |r| Show InChI InChI=1S/C10H13N5O4/c1-5-3-15(10(18)12-9(5)17)8-2-6(13-14-11)7(4-16)19-8/h3,6-8,16H,2,4H2,1H3,(H,12,17,18)/t6-,7+,8+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	12.7	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan University of Technology Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase after 1 hr by ELISA				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.111566 BindingDB Entry DOI: 10.7270/Q2SN0DDN
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50526706 (CHEMBL4545676) Show SMILES COc1ccccc1C(=O)CC1(O)C(=O)Nc2ccc(Cl)cc12 Show InChI InChI=1S/C17H14ClNO4/c1-23-15-5-3-2-4-11(15)14(20)9-17(22)12-8-10(18)6-7-13(12)19-16(17)21/h2-8,22H,9H2,1H3,(H,19,21)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan University of Technology Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase after 1 hr by ELISA				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.111566 BindingDB Entry DOI: 10.7270/Q2SN0DDN
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM222462 ((E)-4-[4-(2-Chlorobenzylidene)-2-(4-chlorophenyl)-...) Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)\C(=C/c2ccccc2Cl)N=C1c1ccc(Cl)cc1 |c:24| Show InChI InChI=1S/C22H15Cl2N3O3S/c23-16-7-5-14(6-8-16)21-26-20(13-15-3-1-2-4-19(15)24)22(28)27(21)17-9-11-18(12-10-17)31(25,29)30/h1-13H,(H2,25,29,30)/b20-13+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	860	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan University of Technology Curated by ChEMBL					Assay Description Inhibition of recombinant human COX2 by EIA				Eur J Med Chem 173: 117-153 (2019) Article DOI: 10.1016/j.ejmech.2019.03.063 BindingDB Entry DOI: 10.7270/Q2QJ7MMT
					More data for this Ligand-Target Pair
Beta-galactosidase (Homo sapiens (Human))	BDBM50520992 (CHEMBL4438366) Show SMILES CCCC[C@@H]1C[C@@H](O)[C@@H](O)[C@@H](O)CN1 |r| Show InChI InChI=1S/C10H21NO3/c1-2-3-4-7-5-8(12)10(14)9(13)6-11-7/h7-14H,2-6H2,1H3/t7-,8-,9+,10-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of beta-galactosidase (unknown origin)				Eur J Med Chem 162: 465-494 (2019) Article DOI: 10.1016/j.ejmech.2018.11.031 BindingDB Entry DOI: 10.7270/Q2154MGW
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425942 (CHEMBL2313740) Show SMILES COc1ccc(NC(=S)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1 Show InChI InChI=1S/C22H23FN4O3S/c1-29-17-5-3-16(4-6-17)25-22(31)24-13-20(28)27-10-8-14(9-11-27)21-18-7-2-15(23)12-19(18)30-26-21/h2-7,12,14H,8-11,13H2,1H3,(H2,24,25,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425923 (CHEMBL2313709) Show SMILES COc1ccc(NC(=S)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1 Show InChI InChI=1S/C25H27FN4O3S/c1-32-19-7-5-18(6-8-19)27-25(34)30-12-2-3-21(30)24(31)29-13-10-16(11-14-29)23-20-9-4-17(26)15-22(20)33-28-23/h4-9,15-16,21H,2-3,10-14H2,1H3,(H,27,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425946 (CHEMBL2313736) Show SMILES COc1ccccc1NC(=S)NCC(=O)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C22H23FN4O3S/c1-29-18-5-3-2-4-17(18)25-22(31)24-13-20(28)27-10-8-14(9-11-27)21-16-7-6-15(23)12-19(16)30-26-21/h2-7,12,14H,8-11,13H2,1H3,(H2,24,25,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425911 (CHEMBL2313700) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1cccc(Br)c1 Show InChI InChI=1S/C24H24BrFN4O2S/c25-16-3-1-4-18(13-16)27-24(33)30-10-2-5-20(30)23(31)29-11-8-15(9-12-29)22-19-7-6-17(26)14-21(19)32-28-22/h1,3-4,6-7,13-15,20H,2,5,8-12H2,(H,27,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Probable maltase-glucoamylase 2 (Homo sapiens)	BDBM50502118 (CHEMBL4476702) Show SMILES Clc1ccc(cc1)-c1nnc(\N=C\c2ccc(Cl)cc2Cl)s1 Show InChI InChI=1S/C15H8Cl3N3S/c16-11-4-1-9(2-5-11)14-20-21-15(22-14)19-8-10-3-6-12(17)7-13(10)18/h1-8H/b19-8+	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan University of Technology Curated by ChEMBL					Assay Description Inhibition of alpha-glucosidase (unknown origin) using p-nitrophenyl-a-d-glucopyranoside as substrate preincubated for 5 mins followed by substrate a...				Eur J Med Chem 173: 117-153 (2019) Article DOI: 10.1016/j.ejmech.2019.03.063 BindingDB Entry DOI: 10.7270/Q2QJ7MMT
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425932 (CHEMBL2313729) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=S)Nc1cccc(Br)c1 Show InChI InChI=1S/C21H20BrFN4O2S/c22-14-2-1-3-16(10-14)25-21(30)24-12-19(28)27-8-6-13(7-9-27)20-17-5-4-15(23)11-18(17)29-26-20/h1-5,10-11,13H,6-9,12H2,(H2,24,25,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425927 (CHEMBL2313705) Show SMILES COc1ccccc1NC(=S)N1CCCC1C(=O)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C25H27FN4O3S/c1-32-21-7-3-2-5-19(21)27-25(34)30-12-4-6-20(30)24(31)29-13-10-16(11-14-29)23-18-9-8-17(26)15-22(18)33-28-23/h2-3,5,7-9,15-16,20H,4,6,10-14H2,1H3,(H,27,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425934 (CHEMBL2313727) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=S)Nc1ccccc1Br Show InChI InChI=1S/C21H20BrFN4O2S/c22-16-3-1-2-4-17(16)25-21(30)24-12-19(28)27-9-7-13(8-10-27)20-15-6-5-14(23)11-18(15)29-26-20/h1-6,11,13H,7-10,12H2,(H2,24,25,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425910 (CHEMBL2313701) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=O)Nc1ccc(Br)cc1 Show InChI InChI=1S/C24H24BrFN4O3/c25-16-3-6-18(7-4-16)27-24(32)30-11-1-2-20(30)23(31)29-12-9-15(10-13-29)22-19-8-5-17(26)14-21(19)33-28-22/h3-8,14-15,20H,1-2,9-13H2,(H,27,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425912 (CHEMBL2313699) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=O)Nc1cccc(Br)c1 Show InChI InChI=1S/C24H24BrFN4O3/c25-16-3-1-4-18(13-16)27-24(32)30-10-2-5-20(30)23(31)29-11-8-15(9-12-29)22-19-7-6-17(26)14-21(19)33-28-22/h1,3-4,6-7,13-15,20H,2,5,8-12H2,(H,27,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425921 (CHEMBL2313711) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1ccccc1F Show InChI InChI=1S/C24H24F2N4O2S/c25-16-7-8-17-21(14-16)32-28-22(17)15-9-12-29(13-10-15)23(31)20-6-3-11-30(20)24(33)27-19-5-2-1-4-18(19)26/h1-2,4-5,7-8,14-15,20H,3,6,9-13H2,(H,27,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425913 (CHEMBL2313698) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1ccccc1Br Show InChI InChI=1S/C24H24BrFN4O2S/c25-18-4-1-2-5-19(18)27-24(33)30-11-3-6-20(30)23(31)29-12-9-15(10-13-29)22-17-8-7-16(26)14-21(17)32-28-22/h1-2,4-5,7-8,14-15,20H,3,6,9-13H2,(H,27,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM222462 ((E)-4-[4-(2-Chlorobenzylidene)-2-(4-chlorophenyl)-...) Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)\C(=C/c2ccccc2Cl)N=C1c1ccc(Cl)cc1 |c:24| Show InChI InChI=1S/C22H15Cl2N3O3S/c23-16-7-5-14(6-8-16)21-26-20(13-15-3-1-2-4-19(15)24)22(28)27(21)17-9-11-18(12-10-17)31(25,29)30/h1-13H,(H2,25,29,30)/b20-13+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan University of Technology Curated by ChEMBL					Assay Description Inhibition of ovine COX1 by EIA				Eur J Med Chem 173: 117-153 (2019) Article DOI: 10.1016/j.ejmech.2019.03.063 BindingDB Entry DOI: 10.7270/Q2QJ7MMT
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425931 (CHEMBL2313730) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=O)Nc1ccc(Br)cc1 Show InChI InChI=1S/C21H20BrFN4O3/c22-14-1-4-16(5-2-14)25-21(29)24-12-19(28)27-9-7-13(8-10-27)20-17-6-3-15(23)11-18(17)30-26-20/h1-6,11,13H,7-10,12H2,(H2,24,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425940 (CHEMBL2313719) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=S)Nc1ccccc1F Show InChI InChI=1S/C21H20F2N4O2S/c22-14-5-6-15-18(11-14)29-26-20(15)13-7-9-27(10-8-13)19(28)12-24-21(30)25-17-4-2-1-3-16(17)23/h1-6,11,13H,7-10,12H2,(H2,24,25,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425933 (CHEMBL2313728) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=O)Nc1cccc(Br)c1 Show InChI InChI=1S/C21H20BrFN4O3/c22-14-2-1-3-16(10-14)25-21(29)24-12-19(28)27-8-6-13(7-9-27)20-17-5-4-15(23)11-18(17)30-26-20/h1-5,10-11,13H,6-9,12H2,(H2,24,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Amyloid-beta precursor protein (Homo sapiens (Human))	BDBM50512315 (CHEMBL4438040) Show SMILES Cl.[#8]-c1c(Cl)cc(-n2[se;v2]c3cccc(F)c3c2=O)c2cccnc12 Show InChI InChI=1S/C16H8ClFN2O2Se/c17-9-7-11(8-3-2-6-19-14(8)15(9)21)20-16(22)13-10(18)4-1-5-12(13)23-20/h1-7,21H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan University of Technology Curated by ChEMBL					Assay Description Inhibition of amyloid beta (1 to 42) (unknown origin) aggregation				Eur J Med Chem 173: 117-153 (2019) Article DOI: 10.1016/j.ejmech.2019.03.063 BindingDB Entry DOI: 10.7270/Q2QJ7MMT
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM192670 (3-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-1-(4-o-...) Show SMILES COc1ccc2N(CCC(=O)N3CCN(CC3)c3ccccc3C)CCCc2c1 Show InChI InChI=1S/C24H31N3O2/c1-19-6-3-4-8-22(19)26-14-16-27(17-15-26)24(28)11-13-25-12-5-7-20-18-21(29-2)9-10-23(20)25/h3-4,6,8-10,18H,5,7,11-17H2,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan University of Technology Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase after 1 hr by ELISA				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.111566 BindingDB Entry DOI: 10.7270/Q2SN0DDN
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425944 (CHEMBL2313738) Show SMILES COc1cccc(NC(=S)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1 Show InChI InChI=1S/C22H23FN4O3S/c1-29-17-4-2-3-16(12-17)25-22(31)24-13-20(28)27-9-7-14(8-10-27)21-18-6-5-15(23)11-19(18)30-26-21/h2-6,11-12,14H,7-10,13H2,1H3,(H2,24,25,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.53E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM192678 (1-(4-(3-chlorophenyl)piperazin-1-yl)-3-(6-methoxy-...) Show SMILES COc1ccc2N(CCC(=O)N3CCN(CC3)c3cccc(Cl)c3)CCCc2c1 Show InChI InChI=1S/C23H28ClN3O2/c1-29-21-7-8-22-18(16-21)4-3-10-26(22)11-9-23(28)27-14-12-25(13-15-27)20-6-2-5-19(24)17-20/h2,5-8,16-17H,3-4,9-15H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.86E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan University of Technology Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase after 1 hr by ELISA				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.111566 BindingDB Entry DOI: 10.7270/Q2SN0DDN
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425943 (CHEMBL2313739) Show SMILES COc1ccc(NC(=O)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1 Show InChI InChI=1S/C22H23FN4O4/c1-30-17-5-3-16(4-6-17)25-22(29)24-13-20(28)27-10-8-14(9-11-27)21-18-7-2-15(23)12-19(18)31-26-21/h2-7,12,14H,8-11,13H2,1H3,(H2,24,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.95E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425947 (CHEMBL2313735) Show SMILES COc1ccccc1NC(=O)NCC(=O)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C22H23FN4O4/c1-30-18-5-3-2-4-17(18)25-22(29)24-13-20(28)27-10-8-14(9-11-27)21-16-7-6-15(23)12-19(16)31-26-21/h2-7,12,14H,8-11,13H2,1H3,(H2,24,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425925 (CHEMBL2313707) Show SMILES COc1cccc(NC(=S)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1 Show InChI InChI=1S/C25H27FN4O3S/c1-32-19-5-2-4-18(15-19)27-25(34)30-11-3-6-21(30)24(31)29-12-9-16(10-13-29)23-20-8-7-17(26)14-22(20)33-28-23/h2,4-5,7-8,14-16,21H,3,6,9-13H2,1H3,(H,27,34)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.05E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Beta-galactosidase (Aspergillus oryzae)	BDBM50520993 (CHEMBL4472415) Show SMILES Cl.O[C@@H]1CN[C@H](CC(O)=O)[C@H](O)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C8H15NO6.ClH/c10-4-2-9-3(1-5(11)12)6(13)8(15)7(4)14;/h3-4,6-10,13-15H,1-2H2,(H,11,12);1H/t3-,4-,6+,7+,8-;/m1./s1	PDB Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
wuhan Institute of Technology Curated by ChEMBL					Assay Description Inhibition of Aspergillus oryzae beta-galactosidase				Eur J Med Chem 162: 465-494 (2019) Article DOI: 10.1016/j.ejmech.2018.11.031 BindingDB Entry DOI: 10.7270/Q2154MGW
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425945 (CHEMBL2313737) Show SMILES COc1cccc(NC(=O)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1 Show InChI InChI=1S/C22H23FN4O4/c1-30-17-4-2-3-16(12-17)25-22(29)24-13-20(28)27-9-7-14(8-10-27)21-18-6-5-15(23)11-19(18)31-26-21/h2-6,11-12,14H,7-10,13H2,1H3,(H2,24,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425924 (CHEMBL2313708) Show SMILES COc1ccc(NC(=O)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1 Show InChI InChI=1S/C25H27FN4O4/c1-33-19-7-5-18(6-8-19)27-25(32)30-12-2-3-21(30)24(31)29-13-10-16(11-14-29)23-20-9-4-17(26)15-22(20)34-28-23/h4-9,15-16,21H,2-3,10-14H2,1H3,(H,27,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.21E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM192669 (3-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-1-(4-ph...) Show SMILES COc1ccc2N(CCC(=O)N3CCN(CC3)c3ccccc3)CCCc2c1 Show InChI InChI=1S/C23H29N3O2/c1-28-21-9-10-22-19(18-21)6-5-12-25(22)13-11-23(27)26-16-14-24(15-17-26)20-7-3-2-4-8-20/h2-4,7-10,18H,5-6,11-17H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan University of Technology Curated by ChEMBL					Assay Description Inhibition of HIV-1 reverse transcriptase after 1 hr by ELISA				Eur J Med Chem 181: (2019) Article DOI: 10.1016/j.ejmech.2019.111566 BindingDB Entry DOI: 10.7270/Q2SN0DDN
					More data for this Ligand-Target Pair
Beta-glucuronidase (Homo sapiens (Human))	BDBM178133 (3-(6-Chloro-1H-imidazo[4,5-b]pyridin-2-yl)benzene-...) Show SMILES Oc1cccc(-c2nc3ncc(Cl)cc3[nH]2)c1O Show InChI InChI=1S/C12H8ClN3O2/c13-6-4-8-12(14-5-6)16-11(15-8)7-2-1-3-9(17)10(7)18/h1-5,17-18H,(H,14,15,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.93E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wuhan University of Technology Curated by ChEMBL					Assay Description Inhibition of beta-glucuronidase (unknown origin) using p-nitrophenyl-beta-D-glucuronide as substrate pre-incubated for 30 mins followed by substrate...				Eur J Med Chem 173: 117-153 (2019) Article DOI: 10.1016/j.ejmech.2019.03.063 BindingDB Entry DOI: 10.7270/Q2QJ7MMT
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425928 (CHEMBL2313704) Show SMILES COc1ccccc1NC(=O)N1CCCC1C(=O)N1CCC(CC1)c1noc2cc(F)ccc12 Show InChI InChI=1S/C25H27FN4O4/c1-33-21-7-3-2-5-19(21)27-25(32)30-12-4-6-20(30)24(31)29-13-10-16(11-14-29)23-18-9-8-17(26)15-22(18)34-28-23/h2-3,5,7-9,15-16,20H,4,6,10-14H2,1H3,(H,27,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD 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 Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425926 (CHEMBL2313706) Show SMILES COc1cccc(NC(=O)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1 Show InChI InChI=1S/C25H27FN4O4/c1-33-19-5-2-4-18(15-19)27-25(32)30-11-3-6-21(30)24(31)29-12-9-16(10-13-29)23-20-8-7-17(26)14-22(20)34-28-23/h2,4-5,7-8,14-16,21H,3,6,9-13H2,1H3,(H,27,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.34E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50217942 (2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chr...) Show SMILES C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(O)c4c(cc(O)cc4=O)oc3-c3ccc(O)c(O)c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O |r| Show InChI InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-30,32-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	4.19E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425922 (CHEMBL2313710) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=O)Nc1ccccc1F Show InChI InChI=1S/C24H24F2N4O3/c25-16-7-8-17-21(14-16)33-28-22(17)15-9-12-29(13-10-15)23(31)20-6-3-11-30(20)24(32)27-19-5-2-1-4-18(19)26/h1-2,4-5,7-8,14-15,20H,3,6,9-13H2,(H,27,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.48E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425941 (CHEMBL2313718) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=O)Nc1ccccc1F Show InChI InChI=1S/C21H20F2N4O3/c22-14-5-6-15-18(11-14)30-26-20(15)13-7-9-27(10-8-13)19(28)12-24-21(29)25-17-4-2-1-3-16(17)23/h1-6,11,13H,7-10,12H2,(H2,24,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425914 (CHEMBL2313697) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C24H24ClFN4O2S/c25-16-3-6-18(7-4-16)27-24(33)30-11-1-2-20(30)23(31)29-12-9-15(10-13-29)22-19-8-5-17(26)14-21(19)32-28-22/h3-8,14-15,20H,1-2,9-13H2,(H,27,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425915 (CHEMBL2313717) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C24H24ClFN4O3/c25-16-3-6-18(7-4-16)27-24(32)30-11-1-2-20(30)23(31)29-12-9-15(10-13-29)22-19-8-5-17(26)14-21(19)33-28-22/h3-8,14-15,20H,1-2,9-13H2,(H,27,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425937 (CHEMBL2313722) Show SMILES Fc1ccc(NC(=S)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1 Show InChI InChI=1S/C21H20F2N4O2S/c22-14-1-4-16(5-2-14)25-21(30)24-12-19(28)27-9-7-13(8-10-27)20-17-6-3-15(23)11-18(17)29-26-20/h1-6,11,13H,7-10,12H2,(H2,24,25,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425918 (CHEMBL2313714) Show SMILES Fc1ccc(NC(=S)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1 Show InChI InChI=1S/C24H24F2N4O2S/c25-16-3-6-18(7-4-16)27-24(33)30-11-1-2-20(30)23(31)29-12-9-15(10-13-29)22-19-8-5-17(26)14-21(19)32-28-22/h3-8,14-15,20H,1-2,9-13H2,(H,27,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425938 (CHEMBL2313721) Show SMILES Fc1ccc(NC(=O)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1 Show InChI InChI=1S/C21H20F2N4O3/c22-14-1-4-16(5-2-14)25-21(29)24-12-19(28)27-9-7-13(8-10-27)20-17-6-3-15(23)11-18(17)30-26-20/h1-6,11,13H,7-10,12H2,(H2,24,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425919 (CHEMBL2313713) Show SMILES Fc1ccc(NC(=O)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)cc1 Show InChI InChI=1S/C24H24F2N4O3/c25-16-3-6-18(7-4-16)27-24(32)30-11-1-2-20(30)23(31)29-12-9-15(10-13-29)22-19-8-5-17(26)14-21(19)33-28-22/h3-8,14-15,20H,1-2,9-13H2,(H,27,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.61E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425935 (CHEMBL2313725) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)CNC(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C21H20ClFN4O3/c22-14-1-4-16(5-2-14)25-21(29)24-12-19(28)27-9-7-13(8-10-27)20-17-6-3-15(23)11-18(17)30-26-20/h1-6,11,13H,7-10,12H2,(H2,24,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.39E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425939 (CHEMBL2313720) Show SMILES Fc1cccc(NC(=O)NCC(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1 Show InChI InChI=1S/C21H20F2N4O3/c22-14-2-1-3-16(10-14)25-21(29)24-12-19(28)27-8-6-13(7-9-27)20-17-5-4-15(23)11-18(17)30-26-20/h1-5,10-11,13H,6-9,12H2,(H2,24,25,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425920 (CHEMBL2313712) Show SMILES Fc1cccc(NC(=O)N2CCCC2C(=O)N2CCC(CC2)c2noc3cc(F)ccc23)c1 Show InChI InChI=1S/C24H24F2N4O3/c25-16-3-1-4-18(13-16)27-24(32)30-10-2-5-20(30)23(31)29-11-8-15(9-12-29)22-19-7-6-17(26)14-21(19)33-28-22/h1,3-4,6-7,13-15,20H,2,5,8-12H2,(H,27,32)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.17E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50425916 (CHEMBL2313716) Show SMILES Fc1ccc2c(noc2c1)C1CCN(CC1)C(=O)C1CCCN1C(=S)Nc1cccc(Cl)c1 Show InChI InChI=1S/C24H24ClFN4O2S/c25-16-3-1-4-18(13-16)27-24(33)30-10-2-5-20(30)23(31)29-11-8-15(9-12-29)22-19-7-6-17(26)14-21(19)32-28-22/h1,3-4,6-7,13-15,20H,2,5,8-12H2,(H,27,33)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Mysore Curated by ChEMBL					Assay Description Inhibition of glycation of bovine serum albumin assessed as advanced glycated end product measured after 7 days by spectrofluorimeter in presence of ...				Eur J Med Chem 60: 325-32 (2013) Article DOI: 10.1016/j.ejmech.2012.12.029 BindingDB Entry DOI: 10.7270/Q2JQ1292
					More data for this Ligand-Target Pair

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