BDBM50152980 (3S,5R)-2-([1,4'']Bipiperidinyl-1''-carbonyl)-4-methoxy-pyrrolidine-1-carboxylic acid 2-chloro-4-(5,6,7,8-tetrahydro-thieno[3,2-b]azepine-4-carbonyl)-benzylamide::CHEMBL443300

SMILES: CO[C@@H]1C[C@H](N(C1)C(=O)NCc1ccc(cc1Cl)C(=O)N1CCCCc2sccc12)C(=O)N1CCC(CC1)N1CCCCC1

InChI Key: InChIKey=QAGFIGGUESYAIG-UHSQPCAPSA-N

Data: 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 2 hits for monomerid = 50152980   

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
Vasopressin V2 receptor (Homo sapiens (Human))	BDBM50152980 ((3S,5R)-2-([1,4'']Bipiperidinyl-1''-carbonyl)-4-me...) Show SMILES CO[C@@H]1C[C@H](N(C1)C(=O)NCc1ccc(cc1Cl)C(=O)N1CCCCc2sccc12)C(=O)N1CCC(CC1)N1CCCCC1 Show InChI InChI=1S/C33H44ClN5O4S/c1-43-26-20-29(32(41)37-16-10-25(11-17-37)36-13-4-2-5-14-36)39(22-26)33(42)35-21-24-9-8-23(19-27(24)34)31(40)38-15-6-3-7-30-28(38)12-18-44-30/h8-9,12,18-19,25-26,29H,2-7,10-11,13-17,20-22H2,1H3,(H,35,42)/t26-,29+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a
Ferring Research Ltd Curated by ChEMBL					Assay Description Effective concentration for human Vassopressin V2 receptor				Bioorg Med Chem Lett 14: 4585-9 (2004) Article DOI: 10.1016/j.bmcl.2004.04.107 BindingDB Entry DOI: 10.7270/Q2DF6QPR
					More data for this Ligand-Target Pair
Oxytocin receptor (Homo sapiens (Human))	BDBM50152980 ((3S,5R)-2-([1,4'']Bipiperidinyl-1''-carbonyl)-4-me...) Show SMILES CO[C@@H]1C[C@H](N(C1)C(=O)NCc1ccc(cc1Cl)C(=O)N1CCCCc2sccc12)C(=O)N1CCC(CC1)N1CCCCC1 Show InChI InChI=1S/C33H44ClN5O4S/c1-43-26-20-29(32(41)37-16-10-25(11-17-37)36-13-4-2-5-14-36)39(22-26)33(42)35-21-24-9-8-23(19-27(24)34)31(40)38-15-6-3-7-30-28(38)12-18-44-30/h8-9,12,18-19,25-26,29H,2-7,10-11,13-17,20-22H2,1H3,(H,35,42)/t26-,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a
Ferring Research Ltd Curated by ChEMBL					Assay Description Effective concentration for human Oxytocin receptor				Bioorg Med Chem Lett 14: 4585-9 (2004) Article DOI: 10.1016/j.bmcl.2004.04.107 BindingDB Entry DOI: 10.7270/Q2DF6QPR
					More data for this Ligand-Target Pair