Compile Data Set for Download or QSAR

Found 7 hits Enz. Inhib. hit(s) with all data for assayid = 3 entry = 50037024   

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
Vesicular glutamate transporter 3 (Rattus norvegicus)	BDBM50113314 (6-Biphenyl-4-yl-quinoline-2,4-dicarboxylic acid | ...) Show SMILES OC(=O)c1cc(C(O)=O)c2cc(ccc2n1)-c1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C23H15NO4/c25-22(26)19-13-21(23(27)28)24-20-11-10-17(12-18(19)20)16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-13H,(H,25,26)(H,27,28)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Estimated inhibitory conc. against Vesicular glutamate transporter (VGLUT), using Cheng-Prushoff equation				J Med Chem 45: 2260-76 (2002) BindingDB Entry DOI: 10.7270/Q2NK3FRR
					More data for this Ligand-Target Pair
Vesicular glutamate transporter 3 (Rattus norvegicus)	BDBM50113320 (6-(2-Biphenyl-4-yl-vinyl)-quinoline-2,4-dicarboxyl...) Show SMILES OC(=O)c1cc(C(O)=O)c2cc(\C=C\c3ccc(cc3)-c3ccccc3)ccc2n1 Show InChI InChI=1S/C25H17NO4/c27-24(28)21-15-23(25(29)30)26-22-13-10-17(14-20(21)22)7-6-16-8-11-19(12-9-16)18-4-2-1-3-5-18/h1-15H,(H,27,28)(H,29,30)/b7-6+	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Estimated inhibitory conc. against Vesicular glutamate transporter (VGLUT), using Cheng-Prushoff equation				J Med Chem 45: 2260-76 (2002) BindingDB Entry DOI: 10.7270/Q2NK3FRR
					More data for this Ligand-Target Pair
Vesicular glutamate transporter 3 (Rattus norvegicus)	BDBM50113321 (6-Phenethyl-quinoline-2,4-dicarboxylic acid | CHEM...) Show SMILES OC(=O)c1cc(C(O)=O)c2cc(CCc3ccccc3)ccc2n1 Show InChI InChI=1S/C19H15NO4/c21-18(22)15-11-17(19(23)24)20-16-9-8-13(10-14(15)16)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2,(H,21,22)(H,23,24)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.43E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Estimated inhibitory conc. against Vesicular glutamate transporter (VGLUT), using Cheng-Prushoff equation				J Med Chem 45: 2260-76 (2002) BindingDB Entry DOI: 10.7270/Q2NK3FRR
					More data for this Ligand-Target Pair
Vesicular glutamate transporter 3 (Rattus norvegicus)	BDBM50113318 (6-Styryl-quinoline-2,4-dicarboxylic acid | CHEMBL7...) Show SMILES OC(=O)c1cc(C(O)=O)c2cc(\C=C\c3ccccc3)ccc2n1 Show InChI InChI=1S/C19H13NO4/c21-18(22)15-11-17(19(23)24)20-16-9-8-13(10-14(15)16)7-6-12-4-2-1-3-5-12/h1-11H,(H,21,22)(H,23,24)/b7-6+	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.67E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Estimated inhibitory conc. against Vesicular glutamate transporter (VGLUT), using Cheng-Prushoff equation				J Med Chem 45: 2260-76 (2002) BindingDB Entry DOI: 10.7270/Q2NK3FRR
					More data for this Ligand-Target Pair
Vesicular glutamate transporter 3 (Rattus norvegicus)	BDBM50113323 (6-Phenethyloxy-quinoline-2,4-dicarboxylic acid | C...) Show SMILES OC(=O)c1cc(C(O)=O)c2cc(OCCc3ccccc3)ccc2n1 Show InChI InChI=1S/C19H15NO5/c21-18(22)15-11-17(19(23)24)20-16-7-6-13(10-14(15)16)25-9-8-12-4-2-1-3-5-12/h1-7,10-11H,8-9H2,(H,21,22)(H,23,24)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.89E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Estimated inhibitory conc. against Vesicular glutamate transporter (VGLUT), using Cheng-Prushoff equation				J Med Chem 45: 2260-76 (2002) BindingDB Entry DOI: 10.7270/Q2NK3FRR
					More data for this Ligand-Target Pair
Vesicular glutamate transporter 3 (Rattus norvegicus)	BDBM50113319 (8-Hydroxy-quinoline-2,4-dicarboxylic acid | CHEMBL...) Show SMILES OC(=O)c1cc(C(O)=O)c2cccc(O)c2n1 Show InChI InChI=1S/C11H7NO5/c13-8-3-1-2-5-6(10(14)15)4-7(11(16)17)12-9(5)8/h1-4,13H,(H,14,15)(H,16,17)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	2.86E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Estimated inhibitory conc. against Vesicular glutamate transporter (VGLUT), using Cheng-Prushoff equation				J Med Chem 45: 2260-76 (2002) BindingDB Entry DOI: 10.7270/Q2NK3FRR
					More data for this Ligand-Target Pair
Vesicular glutamate transporter 3 (Rattus norvegicus)	BDBM50081123 (6-Benzyloxy-quinoline-2,4-dicarboxylic acid | CHEM...) Show SMILES OC(=O)c1cc(C(O)=O)c2cc(OCc3ccccc3)ccc2n1 Show InChI InChI=1S/C18H13NO5/c20-17(21)14-9-16(18(22)23)19-15-7-6-12(8-13(14)15)24-10-11-4-2-1-3-5-11/h1-9H,10H2,(H,20,21)(H,22,23)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	3.68E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Estimated inhibitory conc. against Vesicular glutamate transporter (VGLUT), using Cheng-Prushoff equation				J Med Chem 45: 2260-76 (2002) BindingDB Entry DOI: 10.7270/Q2NK3FRR
					More data for this Ligand-Target Pair