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BDBM50380023 CHEMBL2012510

SMILES: CC[C@@H]1[C@@H](C)C[C@]2(O)[C@@H]([C@@H](C)OC2=O)[C@H]1\C=C\c1ccc(cn1)-c1ccoc1

InChI Key: InChIKey=PCFQUZGCPGWVBP-DKYCFHHISA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50380023   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Proteinase-activated receptor 1


(Homo sapiens (Human))
BDBM50380023
PNG
(CHEMBL2012510)
Show SMILES CC[C@@H]1[C@@H](C)C[C@]2(O)[C@@H]([C@@H](C)OC2=O)[C@H]1\C=C\c1ccc(cn1)-c1ccoc1 |r|
Show InChI InChI=1S/C23H27NO4/c1-4-19-14(2)11-23(26)21(15(3)28-22(23)25)20(19)8-7-18-6-5-16(12-24-18)17-9-10-27-13-17/h5-10,12-15,19-21,26H,4,11H2,1-3H3/b8-7+/t14-,15+,19+,20-,21-,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/an/a 8.60n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [3H]haTRAP from human PAR1 after 1 hr by TopCount scintillation counting


Bioorg Med Chem Lett 22: 2544-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.138
BindingDB Entry DOI: 10.7270/Q20G3M58
More data for this
Ligand-Target Pair