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BDBM50010832 CHEMBL3264793

SMILES: CC1CC(CC(C)N1)NC(=O)c1ccc(Oc2cccc(-c3ccnnc3)c2C#N)c(Cl)c1

InChI Key: InChIKey=IPMLLZQULPEWDG-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50010832   
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
Histone-lysine N-methyltransferase EZH2


(Homo sapiens (Human))
BDBM50010832
PNG
(CHEMBL3264793)
Show SMILES CC1CC(CC(C)N1)NC(=O)c1ccc(Oc2cccc(-c3ccnnc3)c2C#N)c(Cl)c1
Show InChI InChI=1/C25H24ClN5O2/c1-15-10-19(11-16(2)30-15)31-25(32)17-6-7-24(22(26)12-17)33-23-5-3-4-20(21(23)13-27)18-8-9-28-29-14-18/h3-9,12,14-16,19,30H,10-11H2,1-2H3,(H,31,32)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.10E+3n/an/an/an/an/an/a



Constellation Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of wild type EZH2 (unknown origin)


ACS Med Chem Lett 5: 378-83 (2014)


Article DOI: 10.1021/ml400494b
BindingDB Entry DOI: 10.7270/Q2BP04BR
More data for this
Ligand-Target Pair