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BDBM50438877 CHEMBL2420495

SMILES: Clc1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccccc3)c12

InChI Key: InChIKey=YVSMZEICTKINIT-UHFFFAOYSA-N

Data: 2 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50438877   
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
Apurinic-apyrimidinic endonuclease 1 (APE-1)


(Homo sapiens (Human))
BDBM50438877
PNG
(CHEMBL2420495)
Show SMILES Clc1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccccc3)c12
Show InChI InChI=1S/C17H10ClN3O2/c18-13-8-4-5-10-9-12-15(19-17(23)20-16(12)22)21(14(10)13)11-6-2-1-3-7-11/h1-9H,(H,20,22,23)
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of APE-1 (unknown origin) using double-stranded AP-site containing DNA as substrate after 30 mins by fluorescence assay


J Med Chem 56: 6352-70 (2013)


Article DOI: 10.1021/jm400568p
BindingDB Entry DOI: 10.7270/Q2N017ZB
More data for this
Ligand-Target Pair
MDM2-MDMX


(Homo sapiens (Human))
BDBM50438877
PNG
(CHEMBL2420495)
Show SMILES Clc1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccccc3)c12
Show InChI InChI=1S/C17H10ClN3O2/c18-13-8-4-5-10-9-12-15(19-17(23)20-16(12)22)21(14(10)13)11-6-2-1-3-7-11/h1-9H,(H,20,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Nottingham

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged HDM2 (unknown origin) assessed as p53 ubiquitination by Western blot analysis


Bioorg Med Chem 21: 6868-77 (2013)


Article DOI: 10.1016/j.bmc.2013.09.038
BindingDB Entry DOI: 10.7270/Q2KS6T01
More data for this
Ligand-Target Pair
tyrosyl-DNA phosphodiesterase 2


(Homo sapiens (Human))
BDBM50438877
PNG
(CHEMBL2420495)
Show SMILES Clc1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccccc3)c12
Show InChI InChI=1S/C17H10ClN3O2/c18-13-8-4-5-10-9-12-15(19-17(23)20-16(12)22)21(14(10)13)11-6-2-1-3-7-11/h1-9H,(H,20,22,23)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of TDP2 (unknown origin) using 4-nitrophenyl phenylphosphonate as substrate after 60 mins


J Med Chem 56: 6352-70 (2013)


Article DOI: 10.1021/jm400568p
BindingDB Entry DOI: 10.7270/Q2N017ZB
More data for this
Ligand-Target Pair