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BDBM50511445 CHEMBL4568781

SMILES: Cc1cc(-c2cccc(Cl)c2Cl)c2nc(N)[nH]c2c1

InChI Key: InChIKey=RPTCZMDHFOOKHF-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50511445   
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
7,8-dihydro-8-oxoguanine triphosphatase


(Homo sapiens (Human))
BDBM50511445
PNG
(CHEMBL4568781)
Show SMILES Cc1cc(-c2cccc(Cl)c2Cl)c2nc(N)[nH]c2c1
Show InChI InChI=1S/C14H11Cl2N3/c1-7-5-9(8-3-2-4-10(15)12(8)16)13-11(6-7)18-14(17)19-13/h2-6H,1H3,(H3,17,18,19)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Gilead Sciences, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant human His-tagged MTH1 expressed in Escherichia coli BL21 (DE3) using 8-oxo-dGTP as substrate incubated for 15 mins fo...


ACS Med Chem Lett 11: 358-364 (2020)


Article DOI: 10.1021/acsmedchemlett.9b00420
More data for this
Ligand-Target Pair