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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 50429543   
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
P2Y purinoceptor 1


(Homo sapiens (Human))
BDBM50429543
PNG
(CHEMBL2333764)
Show SMILES Fc1ccc(NC(=O)Nc2cccnc2Oc2ccc(cc2)C(F)(F)F)c(F)c1
Show InChI InChI=1S/C19H12F5N3O2/c20-12-5-8-15(14(21)10-12)26-18(28)27-16-2-1-9-25-17(16)29-13-6-3-11(4-7-13)19(22,23)24/h1-10H,(H2,26,27,28)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

>5.00E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
P2Y purinoceptor 1


(Homo sapiens (Human))
BDBM50429543
PNG
(CHEMBL2333764)
Show SMILES Fc1ccc(NC(=O)Nc2cccnc2Oc2ccc(cc2)C(F)(F)F)c(F)c1
Show InChI InChI=1S/C19H12F5N3O2/c20-12-5-8-15(14(21)10-12)26-18(28)27-16-2-1-9-25-17(16)29-13-6-3-11(4-7-13)19(22,23)24/h1-10H,(H2,26,27,28)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>5.00E+3n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Displacement of [beta-33P]-2MeS-ADP from human P2Y1 receptor transfected in HEK293 cells assessed as residual [beta-33P] bound to plate after 1 hr by...


J Med Chem 56: 1704-14 (2013)


Article DOI: 10.1021/jm301708u
BindingDB Entry DOI: 10.7270/Q2ST7R6G
More data for this
Ligand-Target Pair