BDBM50002426 CHEMBL197298

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

InChI Key: InChIKey=PSTYCKJZBHYGPY-UBFVSLLYSA-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 = 50002426   

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))	BDBM50002426 (CHEMBL197298) Show SMILES CC(C)C[C@H]1N([C@@H](C(=O)NC(C)C)c2ccc(cc2)C(N)=O)C(=O)[C@H](NC1=O)C1Cc2ccccc2C1 Show InChI InChI=1S/C29H36N4O4/c1-16(2)13-23-27(35)32-24(22-14-20-7-5-6-8-21(20)15-22)29(37)33(23)25(28(36)31-17(3)4)18-9-11-19(12-10-18)26(30)34/h5-12,16-17,22-25H,13-15H2,1-4H3,(H2,30,34)(H,31,36)(H,32,35)/t23-,24-,25-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	32	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