BDBM50072369 1-{1-[5-Fluoro-2-methoxy-4-((R)-1-pyridin-4-yl-ethoxy)-benzoyl]-piperidin-4-yl}-1,4-dihydro-benzo[d][1,3]oxazin-2-one::CHEMBL104237

SMILES: COc1cc(O[C@H](C)c2ccncc2)c(F)cc1C(=O)N1CCC(CC1)N1C(=O)OCc2ccccc12

InChI Key: InChIKey=KYGLIKUSLNPYID-GOSISDBHSA-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 = 50072369   

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))	BDBM50072369 (1-{1-[5-Fluoro-2-methoxy-4-((R)-1-pyridin-4-yl-eth...) Show SMILES COc1cc(O[C@H](C)c2ccncc2)c(F)cc1C(=O)N1CCC(CC1)N1C(=O)OCc2ccccc12 Show InChI InChI=1S/C28H28FN3O5/c1-18(19-7-11-30-12-8-19)37-26-16-25(35-2)22(15-23(26)29)27(33)31-13-9-21(10-14-31)32-24-6-4-3-5-20(24)17-36-28(32)34/h3-8,11-12,15-16,18,21H,9-10,13-14,17H2,1-2H3/t18-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	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
					More data for this Ligand-Target Pair