Reaction Details Report a problem with these data
Target
DNA-(apurinic or apyrimidinic site) endonuclease
Ligand
BDBM58109
Substrate
n/a
Meas. Tech.
ChEMBL_1750384 (CHEMBL4185144)
IC50
1400±n/a nM
Citation
 Laev, SS; Salakhutdinov, NF; Lavrik, OI Inhibitors of nuclease and redox activity of apurinic/apyrimidinic endonuclease 1/redox effector factor 1 (APE1/Ref-1). Bioorg Med Chem 25:2531-2544 (2017) [PubMed]  Article 
Target
Name:
DNA-(apurinic or apyrimidinic site) endonuclease
Synonyms:
APE | APE1 | APEX | APEX1 | APEX1_HUMAN | APX | Apurinic-apyrimidinic endonuclease 1 (APE-1) | Apurinic/apyrimidinic endonuclease 1 (APE1) | DNA-(apurinic or apyrimidinic site) lyase | HAP1 | REF1
Type:
Protein
Mol. Mass.:
35560.12
Organism:
Homo sapiens (Human)
Description:
P27695
Residue:
318
Sequence:
MPKRGKKGAVAEDGDELRTEPEAKKSKTAAKKNDKEAAGEGPALYEDPPDQKTSPSGKPATLKICSWNVDGLRAWIKKKGLDWVKEEAPDILCLQETKCSENKLPAELQELPGLSHQYWSAPSDKEGYSGVGLLSRQCPLKVSYGIGDEEHDQEGRVIVAEFDSFVLVTAYVPNAGRGLVRLEYRQRWDEAFRKFLKGLASRKPLVLCGDLNVAHEEIDLRNPKGNKKNAGFTPQERQGFGELLQAVPLADSFRHLYPNTPYAYTFWTYMMNARSKNVGWRLDYFLLSHSLLPALCDSKIRSKALGSDHCPITLYLAL
  
Inhibitor
Name:
BDBM58109
Synonyms:
(3-chloranyl-1-benzothiophen-2-yl)-[2-(2-chlorophenyl)imino-4-methylidene-3-thia-1-azaspiro[4.5]decan-1-yl]methanone | (3-chloro-1-benzothiophen-2-yl)-[2-(2-chlorophenyl)imino-4-methylene-3-thia-1-azaspiro[4.5]decan-1-yl]methanone | (3-chloro-1-benzothiophen-2-yl)-[2-(2-chlorophenyl)imino-4-methylidene-3-thia-1-azaspiro[4.5]decan-1-yl]methanone | (3-chlorobenzothiophen-2-yl)-[2-(2-chlorophenyl)imino-4-methylene-3-thia-1-azaspiro[4.5]decan-1-yl]methanone | MLS000757020 | SMR000528915 | cid_329165
Type:
Small organic molecule
Emp. Form.:
C24H20Cl2N2OS2
Mol. Mass.:
487.464
SMILES:
Clc1c(sc2ccccc12)C(=O)N1\C(SC(=C)C11CCCCC1)=N\c1ccccc1Cl
Structure:
Search PDB for entries with ligand similarity: