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BDBM50321588 1-(4-chlorophenyl)-3-(2-(2-isopropylphenyl)benzofuran-7-yl)urea::CHEMBL1170328

SMILES: CC(C)c1ccccc1-c1cc2cccc(NC(=O)Nc3ccc(Cl)cc3)c2o1

InChI Key: InChIKey=PRDOLQMQJKHVJR-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50321588   
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
Purinergic receptor P2Y1


(Homo sapiens (Human))
BDBM50321588
PNG
(1-(4-chlorophenyl)-3-(2-(2-isopropylphenyl)benzofu...)
Show SMILES CC(C)c1ccccc1-c1cc2cccc(NC(=O)Nc3ccc(Cl)cc3)c2o1
Show InChI InChI=1S/C24H21ClN2O2/c1-15(2)19-7-3-4-8-20(19)22-14-16-6-5-9-21(23(16)29-22)27-24(28)26-18-12-10-17(25)11-13-18/h3-15H,1-2H3,(H2,26,27,28)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
760n/an/an/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Displacement of [33P]2-MeS-ADP from human P2Y1 receptor expressed in human U2OS cells by scintillation counting


Bioorg Med Chem Lett 20: 4104-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.05.072
BindingDB Entry DOI: 10.7270/Q2HX1DNF
More data for this
Ligand-Target Pair
Purinergic receptor P2Y1


(Homo sapiens (Human))
BDBM50321588
PNG
(1-(4-chlorophenyl)-3-(2-(2-isopropylphenyl)benzofu...)
Show SMILES CC(C)c1ccccc1-c1cc2cccc(NC(=O)Nc3ccc(Cl)cc3)c2o1
Show InChI InChI=1S/C24H21ClN2O2/c1-15(2)19-7-3-4-8-20(19)22-14-16-6-5-9-21(23(16)29-22)27-24(28)26-18-12-10-17(25)11-13-18/h3-15H,1-2H3,(H2,26,27,28)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity at P2Y1 expressed in HEK293 cells by FLIPR assay


Bioorg Med Chem Lett 20: 4104-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.05.072
BindingDB Entry DOI: 10.7270/Q2HX1DNF
More data for this
Ligand-Target Pair