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BDBM50495476 CHEMBL3109078

SMILES: OC(=O)[C@H]1[C@@H](Cc2c[nH]c3ccccc23)CCN1C(=O)c1ccccc1

InChI Key: InChIKey=SFTGLDWKERDMBL-DNVCBOLYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50495476   
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
DNA (cytosine-5)-methyltransferase 1


(Homo sapiens (Human))
BDBM50495476
PNG
(CHEMBL3109078)
Show SMILES OC(=O)[C@H]1[C@@H](Cc2c[nH]c3ccccc23)CCN1C(=O)c1ccccc1 |r|
Show InChI InChI=1S/C21H20N2O3/c24-20(14-6-2-1-3-7-14)23-11-10-15(19(23)21(25)26)12-16-13-22-18-9-5-4-8-17(16)18/h1-9,13,15,19,22H,10-12H2,(H,25,26)/t15-,19-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.30E+4n/an/an/an/an/an/a



Universit£ Pierre et Marie Curie-Paris 6

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DNMT1 expressed in H19 cells assessed as inhibition of tritiated methyl incorporation from [3H]-labeled AdoMet into h...


J Med Chem 57: 421-34 (2014)


Article DOI: 10.1021/jm401419p
BindingDB Entry DOI: 10.7270/Q2QN69Q3
More data for this
Ligand-Target Pair