BDBM50002411 CHEMBL382065

SMILES: CC(C)C[C@H]1N([C@@H](C(=O)NC(C)(C)C)c2ccc(cc2)N2CCN(C)CC2)C(=O)[C@H](NC1=O)C1Cc2ccccc2C1

InChI Key: InChIKey=ZHVLUANHYSPVLM-IDZRBWSNSA-N

Data: 1 KI

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 1 hit for monomerid = 50002411   

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
Oxytocin receptor (Homo sapiens (Human))	BDBM50002411 (CHEMBL382065) Show SMILES CC(C)C[C@H]1N([C@@H](C(=O)NC(C)(C)C)c2ccc(cc2)N2CCN(C)CC2)C(=O)[C@H](NC1=O)C1Cc2ccccc2C1 Show InChI InChI=1S/C34H47N5O3/c1-22(2)19-28-31(40)35-29(26-20-24-9-7-8-10-25(24)21-26)33(42)39(28)30(32(41)36-34(3,4)5)23-11-13-27(14-12-23)38-17-15-37(6)16-18-38/h7-14,22,26,28-30H,15-21H2,1-6H3,(H,35,40)(H,36,41)/t28-,29-,30-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research and Development Curated by ChEMBL					Assay Description Displacement of [3H]oxytocin from human Oxytocin receptor				J Med Chem 48: 6956-69 (2005) Checked by Author Article DOI: 10.1021/jm050557v BindingDB Entry DOI: 10.7270/Q2TX3GWZ
					More data for this Ligand-Target Pair