BDBM50445379 CHEMBL3104640

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](CC2CCCCC2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O

InChI Key: InChIKey=UZMIGSOIZBJATB-PJKCPVONSA-N

Data: 2 IC50  2 EC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50445379   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
UTS2R (RAT)	BDBM50445379 (CHEMBL3104640) 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](CC2CCCCC2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C47H69N9O10S2/c1-27(2)39(47(65)66)56-46(64)38-26-68-67-25-37(54-40(58)28(3)49)45(63)53-35(23-30-14-8-5-9-15-30)43(61)52-34(22-29-12-6-4-7-13-29)42(60)50-33(16-10-11-21-48)41(59)51-36(44(62)55-38)24-31-17-19-32(57)20-18-31/h5,8-9,14-15,17-20,27-29,33-39,57H,4,6-7,10-13,16,21-26,48-49H2,1-3H3,(H,50,60)(H,51,59)(H,52,61)(H,53,63)(H,54,58)(H,55,62)(H,56,64)(H,65,66)/t28-,33-,34-,35-,36-,37-,38-,39-/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	>1.00E+3	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 II receptor (Homo sapiens (Human))	BDBM50445379 (CHEMBL3104640) 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](CC2CCCCC2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C47H69N9O10S2/c1-27(2)39(47(65)66)56-46(64)38-26-68-67-25-37(54-40(58)28(3)49)45(63)53-35(23-30-14-8-5-9-15-30)43(61)52-34(22-29-12-6-4-7-13-29)42(60)50-33(16-10-11-21-48)41(59)51-36(44(62)55-38)24-31-17-19-32(57)20-18-31/h5,8-9,14-15,17-20,27-29,33-39,57H,4,6-7,10-13,16,21-26,48-49H2,1-3H3,(H,50,60)(H,51,59)(H,52,61)(H,53,63)(H,54,58)(H,55,62)(H,56,64)(H,65,66)/t28-,33-,34-,35-,36-,37-,38-,39-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	181	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
UTS2R (RAT)	BDBM50445379 (CHEMBL3104640) 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](CC2CCCCC2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C47H69N9O10S2/c1-27(2)39(47(65)66)56-46(64)38-26-68-67-25-37(54-40(58)28(3)49)45(63)53-35(23-30-14-8-5-9-15-30)43(61)52-34(22-29-12-6-4-7-13-29)42(60)50-33(16-10-11-21-48)41(59)51-36(44(62)55-38)24-31-17-19-32(57)20-18-31/h5,8-9,14-15,17-20,27-29,33-39,57H,4,6-7,10-13,16,21-26,48-49H2,1-3H3,(H,50,60)(H,51,59)(H,52,61)(H,53,63)(H,54,58)(H,55,62)(H,56,64)(H,65,66)/t28-,33-,34-,35-,36-,37-,38-,39-/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	>1.00E+3	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 II receptor (Homo sapiens (Human))	BDBM50445379 (CHEMBL3104640) 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](CC2CCCCC2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N1)C(O)=O |r| Show InChI InChI=1S/C47H69N9O10S2/c1-27(2)39(47(65)66)56-46(64)38-26-68-67-25-37(54-40(58)28(3)49)45(63)53-35(23-30-14-8-5-9-15-30)43(61)52-34(22-29-12-6-4-7-13-29)42(60)50-33(16-10-11-21-48)41(59)51-36(44(62)55-38)24-31-17-19-32(57)20-18-31/h5,8-9,14-15,17-20,27-29,33-39,57H,4,6-7,10-13,16,21-26,48-49H2,1-3H3,(H,50,60)(H,51,59)(H,52,61)(H,53,63)(H,54,58)(H,55,62)(H,56,64)(H,65,66)/t28-,33-,34-,35-,36-,37-,38-,39-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	182	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