BDBM50072370 1-[1-(4-Benzhydryloxy-2-methoxy-benzoyl)-piperidin-4-yl]-1,4-dihydro-benzo[d][1,3]oxazin-2-one::CHEMBL322162

SMILES: COc1cc(OC(c2ccccc2)c2ccccc2)ccc1C(=O)N1CCC(CC1)N1C(=O)OCc2ccccc12

InChI Key: InChIKey=IGDLXBCMFSBIRQ-UHFFFAOYSA-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 = 50072370   

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))	BDBM50072370 (1-[1-(4-Benzhydryloxy-2-methoxy-benzoyl)-piperidin...) Show SMILES COc1cc(OC(c2ccccc2)c2ccccc2)ccc1C(=O)N1CCC(CC1)N1C(=O)OCc2ccccc12 Show InChI InChI=1S/C34H32N2O5/c1-39-31-22-28(41-32(24-10-4-2-5-11-24)25-12-6-3-7-13-25)16-17-29(31)33(37)35-20-18-27(19-21-35)36-30-15-9-8-14-26(30)23-40-34(36)38/h2-17,22,27,32H,18-21,23H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding affinity against cloned human oxytocin receptor from human embryonic kidney cells				Bioorg Med Chem Lett 8: 3081-6 (1999) Article DOI: 10.1016/S0960-894X(98)00568-X BindingDB Entry DOI: 10.7270/Q298865X
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