Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Urotensin-2 receptor' and Ligand = 'BDBM50445378'   

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
Urotensin-2 receptor (Homo sapiens (Human))	BDBM50445378 (CHEMBL3104642) Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(C)(C)C)C(O)=O |r| Show InChI InChI=1S/C44H65N9O10S2/c1-24(2)34(43(62)63)52-41(60)33-23-65-64-22-32(50-36(55)25(3)46)40(59)49-31(20-26-12-8-7-9-13-26)39(58)53-35(44(4,5)6)42(61)47-29(14-10-11-19-45)37(56)48-30(38(57)51-33)21-27-15-17-28(54)18-16-27/h7-9,12-13,15-18,24-25,29-35,54H,10-11,14,19-23,45-46H2,1-6H3,(H,47,61)(H,48,56)(H,49,59)(H,50,55)(H,51,57)(H,52,60)(H,53,58)(H,62,63)/t25-,29-,30-,31-,32-,33-,34-,35-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>0	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ du Qu£bec Curated by ChEMBL					Assay Description Displacement of [125I]-Urotensin-2 from human GPR14 expressed in CHO cells after 90 mins by gamma counting analysis				J Med Chem 56: 9612-22 (2014) Article DOI: 10.1021/jm401153j BindingDB Entry DOI: 10.7270/Q2TD9ZTZ
					More data for this Ligand-Target Pair
Urotensin-2 receptor (Homo sapiens (Human))	BDBM50445378 (CHEMBL3104642) Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(C)(C)C)C(O)=O |r| Show InChI InChI=1S/C44H65N9O10S2/c1-24(2)34(43(62)63)52-41(60)33-23-65-64-22-32(50-36(55)25(3)46)40(59)49-31(20-26-12-8-7-9-13-26)39(58)53-35(44(4,5)6)42(61)47-29(14-10-11-19-45)37(56)48-30(38(57)51-33)21-27-15-17-28(54)18-16-27/h7-9,12-13,15-18,24-25,29-35,54H,10-11,14,19-23,45-46H2,1-6H3,(H,47,61)(H,48,56)(H,49,59)(H,50,55)(H,51,57)(H,52,60)(H,53,58)(H,62,63)/t25-,29-,30-,31-,32-,33-,34-,35-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>0	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ du Qu£bec Curated by ChEMBL					Assay Description Displacement of [125I]-Urotensin-2 from human GPR14 expressed in CHO cells after 90 mins by gamma counting analysis				J Med Chem 56: 9612-22 (2014) Article DOI: 10.1021/jm401153j BindingDB Entry DOI: 10.7270/Q2TD9ZTZ
					More data for this Ligand-Target Pair
Urotensin-2 receptor (RAT)	BDBM50445378 (CHEMBL3104642) Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(C)(C)C)C(O)=O |r| Show InChI InChI=1S/C44H65N9O10S2/c1-24(2)34(43(62)63)52-41(60)33-23-65-64-22-32(50-36(55)25(3)46)40(59)49-31(20-26-12-8-7-9-13-26)39(58)53-35(44(4,5)6)42(61)47-29(14-10-11-19-45)37(56)48-30(38(57)51-33)21-27-15-17-28(54)18-16-27/h7-9,12-13,15-18,24-25,29-35,54H,10-11,14,19-23,45-46H2,1-6H3,(H,47,61)(H,48,56)(H,49,59)(H,50,55)(H,51,57)(H,52,60)(H,53,58)(H,62,63)/t25-,29-,30-,31-,32-,33-,34-,35-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>0	n/a	n/a	n/a	n/a
Universit£ du Qu£bec Curated by ChEMBL					Assay Description Agonist activity at urotensin-2 receptor in Sprague-Dawley rat aortic rings assessed as KCl-induced vasoconstriction				J Med Chem 56: 9612-22 (2014) Article DOI: 10.1021/jm401153j BindingDB Entry DOI: 10.7270/Q2TD9ZTZ
					More data for this Ligand-Target Pair
Urotensin-2 receptor (RAT)	BDBM50445378 (CHEMBL3104642) Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CSSC[C@H](NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(C)(C)C)C(O)=O |r| Show InChI InChI=1S/C44H65N9O10S2/c1-24(2)34(43(62)63)52-41(60)33-23-65-64-22-32(50-36(55)25(3)46)40(59)49-31(20-26-12-8-7-9-13-26)39(58)53-35(44(4,5)6)42(61)47-29(14-10-11-19-45)37(56)48-30(38(57)51-33)21-27-15-17-28(54)18-16-27/h7-9,12-13,15-18,24-25,29-35,54H,10-11,14,19-23,45-46H2,1-6H3,(H,47,61)(H,48,56)(H,49,59)(H,50,55)(H,51,57)(H,52,60)(H,53,58)(H,62,63)/t25-,29-,30-,31-,32-,33-,34-,35-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>0	n/a	n/a	n/a	n/a
Universit£ du Qu£bec Curated by ChEMBL					Assay Description Agonist activity at urotensin-2 receptor in Sprague-Dawley rat aortic rings assessed as KCl-induced vasoconstriction				J Med Chem 56: 9612-22 (2014) Article DOI: 10.1021/jm401153j BindingDB Entry DOI: 10.7270/Q2TD9ZTZ
					More data for this Ligand-Target Pair