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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Proteinase-activated receptor 1' and Ligand = 'BDBM50191050'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Proteinase-activated receptor 1


(Homo sapiens (Human))
BDBM50191050
PNG
(6-methoxy-2-(2-((1R,3R,3aS,4S,4aR,8aS,9aR)-1-metho...)
Show SMILES CO[C@@H]1O[C@H](C)[C@@H]2[C@H]1C[C@@H]1CCCC[C@H]1[C@@H]2\C=C\c1ccc2cc(OC)ccc2n1
Show InChI InChI=1S/C26H33NO3/c1-16-25-22(21-7-5-4-6-17(21)15-23(25)26(29-3)30-16)12-10-19-9-8-18-14-20(28-2)11-13-24(18)27-19/h8-14,16-17,21-23,25-26H,4-7,15H2,1-3H3/b12-10+/t16-,17+,21-,22+,23-,25+,26-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 217n/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to PAR1 in human platelet membrane


Bioorg Med Chem Lett 16: 4969-72 (2006)


Article DOI: 10.1016/j.bmcl.2006.06.042
BindingDB Entry DOI: 10.7270/Q2CV4HC9
More data for this
Ligand-Target Pair