Brief Information of the Compound and Protein
Compound Name
(1R,3aR,4aR,6R,8aR,9S,9aS)-9-[(E)-2-[5-(3-fluorophenyl)pyridin-2-yl]ethenyl]-1-methyl-6-[(4-methylpyrimidin-2-yl)amino]-3a,4,4a,5,6,7,8,8a,9,9a-decahydro-1H-benzo[f][2]benzofuran-3-one
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PubChem ID
CID: 145386418
Canonical SMILES
C[C@H]1OC(=O)[C@@H]2C[C@@H]3C[C@@H](CC[C@H]3[C@H](\C=C\c3ccc(cn3)-c3cccc(F)c3)[C@H]12)Nc1nccc(C)n1
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Compound Formula C31H33FN4O2
Compound Structure
Protein Name
Proteinase-activated receptor 1
Protein Classification
Membrane receptor
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Family A G protein-coupled receptor
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Peptide receptor (family A GPCR)
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Protease-activated receptor
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Protease-activated receptor
Uniprot ID
P25116
Gene Name
F2R
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000667 KNRK Rattus norvegicus (Rat)  1
1
IC50 = 610 nM
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