BDBM50212435 (3aR,4R,9aS,E)-8-fluoro-4-(2-(5-(3-fluorophenyl)pyridin-2-yl)vinyl)-3a,4,9,9a-tetrahydronaphtho[2,3-c]furan-1(3H)-one::CHEMBL399407

SMILES: Fc1cccc(c1)-c1ccc(\C=C\[C@@H]2[C@H]3COC(=O)[C@H]3Cc3c(F)cccc23)nc1

InChI Key: InChIKey=CIITXDCSDLBBPO-AEXASODUSA-N

Data: 1 IC50

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 = 50212435   

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
Proteinase-activated receptor 1 (Homo sapiens (Human))	BDBM50212435 ((3aR,4R,9aS,E)-8-fluoro-4-(2-(5-(3-fluorophenyl)py...) Show SMILES Fc1cccc(c1)-c1ccc(\C=C\[C@@H]2[C@H]3COC(=O)[C@H]3Cc3c(F)cccc23)nc1 Show InChI InChI=1S/C25H19F2NO2/c26-17-4-1-3-15(11-17)16-7-8-18(28-13-16)9-10-20-19-5-2-6-24(27)21(19)12-22-23(20)14-30-25(22)29/h1-11,13,20,22-23H,12,14H2/b10-9+/t20-,22-,23+/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20.5	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]haTRAP from PAR1				Bioorg Med Chem Lett 17: 3647-51 (2007) Article DOI: 10.1016/j.bmcl.2007.04.061 BindingDB Entry DOI: 10.7270/Q2JH3KV4
					More data for this Ligand-Target Pair