BDBM50329617 CHEMBL1270636::ethyl(1R,3aR,4aR,6R,8aR,9S,9aS)-9-((E)-2-(5-(2-methoxyphenyl)pyridin-2-yl)vinyl)-1-methyl-3-oxododecahydronaphtho[2,3-c]furan-6-ylcarbamate

SMILES: CCOC(=O)N[C@@H]1CC[C@@H]2[C@H](C[C@@H]3[C@@H]([C@@H](C)OC3=O)[C@H]2C=Cc2ccc(cn2)-c2ccccc2OC)C1

InChI Key: InChIKey=FXGKWUFRBYJDLB-GOVGUOIOSA-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 = 50329617   

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))	BDBM50329617 (CHEMBL1270636 | ethyl(1R,3aR,4aR,6R,8aR,9S,9aS)-9-...) Show SMILES CCOC(=O)N[C@@H]1CC[C@@H]2[C@H](C[C@@H]3[C@@H]([C@@H](C)OC3=O)[C@H]2C=Cc2ccc(cn2)-c2ccccc2OC)C1 |r,w:21.23| Show InChI InChI=1S/C30H36N2O5/c1-4-36-30(34)32-22-12-13-23-20(15-22)16-26-28(18(2)37-29(26)33)25(23)14-11-21-10-9-19(17-31-21)24-7-5-6-8-27(24)35-3/h5-11,14,17-18,20,22-23,25-26,28H,4,12-13,15-16H2,1-3H3,(H,32,34)/t18-,20+,22-,23-,25+,26-,28+/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of high affinity TRAP form human platelet PAR1				Bioorg Med Chem Lett 20: 6676-9 (2010) Article DOI: 10.1016/j.bmcl.2010.09.009 BindingDB Entry DOI: 10.7270/Q2KS6RSH
					More data for this Ligand-Target Pair