Compile Data Set for Download or QSAR

Found 19 hits with Last Name = 'ramesh' and Initial = 'k'   

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
Adenosine deaminase (Homo sapiens (Human))	BDBM50368778 (CHEMBL610668) Show SMILES Nc1nncc2n(nnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C9H12N6O4/c10-8-5-3(1-11-13-8)15(14-12-5)9-7(18)6(17)4(2-16)19-9/h1,4,6-7,9,16-18H,2H2,(H2,10,13)/t4-,6-,7-,9?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.41E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Rhode Island Curated by ChEMBL					Assay Description Tested for inhibition against human plasma adenosine deaminase (ADA2)				J Med Chem 36: 4113-20 (1994) BindingDB Entry DOI: 10.7270/Q2B27VXH
					More data for this Ligand-Target Pair
Adenosine deaminase (Homo sapiens (Human))	BDBM14487 ((2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxy...) Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O Show InChI InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	DrugBank PubMed	2.18E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Rhode Island Curated by ChEMBL					Assay Description Tested for binding constant against adenosine deaminase (ADA2) in human plasma				J Med Chem 36: 4113-20 (1994) BindingDB Entry DOI: 10.7270/Q2B27VXH
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM23406 ((3R,4R,5S,6R)-5-{[(2R,3R,4R,5S,6R)-5-{[(2R,3R,4S,5...) Show SMILES C[C@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@H](O[C@@H]3[C@@H](CO)OC(O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O |t:37| Show InChI InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23?,24-,25-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	8.93E+3	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic alpha-amylase using starch as substrate after 30 mins by iodine reagent based assay				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM50182491 (CHEBI:69015 | Malabaricone C) Show SMILES Oc1ccc(CCCCCCCCC(=O)c2c(O)cccc2O)cc1O Show InChI InChI=1S/C21H26O5/c22-16-13-12-15(14-20(16)26)8-5-3-1-2-4-6-9-17(23)21-18(24)10-7-11-19(21)25/h7,10-14,22,24-26H,1-6,8-9H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic alpha-amylase using starch as substrate after 30 mins by iodine reagent based assay				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM50182486 (MALABARICONE B) Show SMILES Oc1ccc(CCCCCCCCC(=O)c2c(O)cccc2O)cc1 Show InChI InChI=1S/C21H26O4/c22-17-14-12-16(13-15-17)8-5-3-1-2-4-6-9-18(23)21-19(24)10-7-11-20(21)25/h7,10-15,22,24-25H,1-6,8-9H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic alpha-amylase using starch as substrate after 30 mins by iodine reagent based assay				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50182491 (CHEBI:69015 | Malabaricone C) Show SMILES Oc1ccc(CCCCCCCCC(=O)c2c(O)cccc2O)cc1O Show InChI InChI=1S/C21H26O5/c22-16-13-12-15(14-20(16)26)8-5-3-1-2-4-6-9-17(23)21-18(24)10-7-11-19(21)25/h7,10-14,22,24-26H,1-6,8-9H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Antiglycation activity in bovine serum albumin assessed as inhibition of advanced glycated end product formation after 24 hrs in presence of alpha-D-...				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM50182487 (Malabaricone A) Show SMILES Oc1cccc(O)c1C(=O)CCCCCCCCc1ccccc1 Show InChI InChI=1S/C21H26O3/c22-18(21-19(23)15-10-16-20(21)24)14-9-4-2-1-3-6-11-17-12-7-5-8-13-17/h5,7-8,10,12-13,15-16,23-24H,1-4,6,9,11,14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.91E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic alpha-amylase using starch as substrate after 30 mins by iodine reagent based assay				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50182487 (Malabaricone A) Show SMILES Oc1cccc(O)c1C(=O)CCCCCCCCc1ccccc1 Show InChI InChI=1S/C21H26O3/c22-18(21-19(23)15-10-16-20(21)24)14-9-4-2-1-3-6-11-17-12-7-5-8-13-17/h5,7-8,10,12-13,15-16,23-24H,1-4,6,9,11,14H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.93E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Antiglycation activity in bovine serum albumin assessed as inhibition of advanced glycated end product formation after 24 hrs in presence of alpha-D-...				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM50274062 (CHEMBL491789) Show SMILES COc1cccc(O)c1C(=O)CCCCCCCCc1ccc(O)cc1 Show InChI InChI=1S/C22H28O4/c1-26-21-12-8-11-20(25)22(21)19(24)10-7-5-3-2-4-6-9-17-13-15-18(23)16-14-17/h8,11-16,23,25H,2-7,9-10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic alpha-amylase using starch as substrate after 30 mins by iodine reagent based assay				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM50274065 (CHEMBL4128067) Show SMILES CCCCCCCCCCCCC(=O)c1cccc(c1)C(O)=O Show InChI InChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-11-15-19(21)17-13-12-14-18(16-17)20(22)23/h12-14,16H,2-11,15H2,1H3,(H,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic alpha-amylase using starch as substrate after 30 mins by iodine reagent based assay				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM50274064 (CHEMBL4126685) Show SMILES CCCCCCCCCCCCCC(=O)c1c(O)cccc1OC Show InChI InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-15-18(22)21-19(23)16-14-17-20(21)24-2/h14,16-17,23H,3-13,15H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic alpha-amylase using starch as substrate after 30 mins by iodine reagent based assay				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50182486 (MALABARICONE B) Show SMILES Oc1ccc(CCCCCCCCC(=O)c2c(O)cccc2O)cc1 Show InChI InChI=1S/C21H26O4/c22-17-14-12-16(13-15-17)8-5-3-1-2-4-6-9-18(23)21-19(24)10-7-11-20(21)25/h7,10-15,22,24-25H,1-6,8-9H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Antiglycation activity in bovine serum albumin assessed as inhibition of advanced glycated end product formation after 24 hrs in presence of alpha-D-...				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Pancreatic alpha-amylase (Sus scrofa (Pig))	BDBM50274066 (CHEMBL4126837) Show SMILES CCCCCCCCCCCCCC(=O)c1c(O)cccc1O Show InChI InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-17(21)20-18(22)15-13-16-19(20)23/h13,15-16,22-23H,2-12,14H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic alpha-amylase using starch as substrate after 30 mins by iodine reagent based assay				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50274062 (CHEMBL491789) Show SMILES COc1cccc(O)c1C(=O)CCCCCCCCc1ccc(O)cc1 Show InChI InChI=1S/C22H28O4/c1-26-21-12-8-11-20(25)22(21)19(24)10-7-5-3-2-4-6-9-17-13-15-18(23)16-14-17/h8,11-16,23,25H,2-7,9-10H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.04E+5	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Antiglycation activity in bovine serum albumin assessed as inhibition of advanced glycated end product formation after 24 hrs in presence of alpha-D-...				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50274066 (CHEMBL4126837) Show SMILES CCCCCCCCCCCCCC(=O)c1c(O)cccc1O Show InChI InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-17(21)20-18(22)15-13-16-19(20)23/h13,15-16,22-23H,2-12,14H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.21E+5	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Antiglycation activity in bovine serum albumin assessed as inhibition of advanced glycated end product formation after 24 hrs in presence of alpha-D-...				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50351096 (ASCORBIC ACID) Show SMILES OC[C@H](O)[C@H]1OC(=O)C(=O)C1O |r| Show InChI InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2-3,5,7-9H,1H2/t2-,3?,5+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.55E+5	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Antiglycation activity in bovine serum albumin assessed as inhibition of advanced glycated end product formation after 24 hrs in presence of alpha-D-...				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50274064 (CHEMBL4126685) Show SMILES CCCCCCCCCCCCCC(=O)c1c(O)cccc1OC Show InChI InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-15-18(22)21-19(23)16-14-17-20(21)24-2/h14,16-17,23H,3-13,15H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.92E+5	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Antiglycation activity in bovine serum albumin assessed as inhibition of advanced glycated end product formation after 24 hrs in presence of alpha-D-...				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Albumin (Bos taurus)	BDBM50274065 (CHEMBL4128067) Show SMILES CCCCCCCCCCCCC(=O)c1cccc(c1)C(O)=O Show InChI InChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-11-15-19(21)17-13-12-14-18(16-17)20(22)23/h12-14,16H,2-11,15H2,1H3,(H,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.11E+5	n/a	n/a	n/a	n/a	n/a	n/a
CSIR-National Institute for Interdisciplinary Science and Technology Curated by ChEMBL					Assay Description Antiglycation activity in bovine serum albumin assessed as inhibition of advanced glycated end product formation after 24 hrs in presence of alpha-D-...				Bioorg Med Chem 26: 3461-3467 (2018) Article DOI: 10.1016/j.bmc.2018.05.020 BindingDB Entry DOI: 10.7270/Q2NS0XD0
					More data for this Ligand-Target Pair
Adenosine receptor A2a (Homo sapiens (Human))	BDBM14487 ((2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxy...) Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O Show InChI InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	DrugBank PDB PubMed	n/a	n/a	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a
University of Rhode Island Curated by ChEMBL					Assay Description Effective concentration required for cyclic AMP dependent inhibition of blood platelet aggregation for A2 receptor stimulation				J Med Chem 36: 4113-20 (1994) BindingDB Entry DOI: 10.7270/Q2B27VXH
					More data for this Ligand-Target Pair				3D Structure (crystal)