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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Telomerase reverse transcriptase' and Ligand = 'BDBM50233823'   
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
Telomerase reverse transcriptase


(Homo sapiens (Human))
BDBM50233823
PNG
(CHEMBL4097807)
Show SMILES Oc1cccc(C(=O)Nc2cc([123I])cc(NC(=O)c3cccc(O)c3O)c2)c1O
Show InChI InChI=1S/C20H15IN2O6/c21-10-7-11(22-19(28)13-3-1-5-15(24)17(13)26)9-12(8-10)23-20(29)14-4-2-6-16(25)18(14)27/h1-9,24-27H,(H,22,28)(H,23,29)
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Article
PubMed
n/an/a 1.58E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Inhibition of telomerase activity in human MDA-MB-435 cell lysate measured after 24 hrs by TRAP assay


Eur J Med Chem 125: 117-129 (2017)


Article DOI: 10.1016/j.ejmech.2016.09.028
BindingDB Entry DOI: 10.7270/Q2NS0X5V
More data for this
Ligand-Target Pair
Telomerase reverse transcriptase


(Homo sapiens (Human))
BDBM50233823
PNG
(CHEMBL4097807)
Show SMILES Oc1cccc(C(=O)Nc2cc([123I])cc(NC(=O)c3cccc(O)c3O)c2)c1O
Show InChI InChI=1S/C20H15IN2O6/c21-10-7-11(22-19(28)13-3-1-5-15(24)17(13)26)9-12(8-10)23-20(29)14-4-2-6-16(25)18(14)27/h1-9,24-27H,(H,22,28)(H,23,29)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.58E+3n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Inhibition of telomerase activity in human U2OS cell lysate measured after 24 hrs by TRAP assay


Eur J Med Chem 125: 117-129 (2017)


Article DOI: 10.1016/j.ejmech.2016.09.028
BindingDB Entry DOI: 10.7270/Q2NS0X5V
More data for this
Ligand-Target Pair