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Target
DNA polymerase beta
Ligand
BDBM50442234
Substrate
n/a
Meas. Tech.
ChEMBL_991706 (CHEMBL2445054)
IC50
>40000±n/a nM
Citation
 Costi, R; Crucitti, GC; Pescatori, L; Messore, A; Scipione, L; Tortorella, S; Amoroso, A; Crespan, E; Campiglia, P; Maresca, B; Porta, A; Granata, I; Novellino, E; Gouge, J; Delarue, M; Maga, G; Di Santo, R New nucleotide-competitive non-nucleoside inhibitors of terminal deoxynucleotidyl transferase: discovery, characterization, and crystal structure in complex with the target. J Med Chem 56:7431-41 (2013) [PubMed]  Article 
Target
Name:
DNA polymerase beta
Synonyms:
DNA polymerase beta (Pol β) | DPOLB_HUMAN | POLB
Type:
Protein
Mol. Mass.:
38188.76
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
335
Sequence:
MSKRKAPQETLNGGITDMLTELANFEKNVSQAIHKYNAYRKAASVIAKYPHKIKSGAEAKKLPGVGTKIAEKIDEFLATGKLRKLEKIRQDDTSSSINFLTRVSGIGPSAARKFVDEGIKTLEDLRKNEDKLNHHQRIGLKYFGDFEKRIPREEMLQMQDIVLNEVKKVDSEYIATVCGSFRRGAESSGDMDVLLTHPSFTSESTKQPKLLHQVVEQLQKVHFITDTLSKGETKFMGVCQLPSKNDEKEYPHRRIDIRLIPKDQYYCGVLYFTGSDIFNKNMRAHALEKGFTINEYTIRPLGVTGVAGEPLPVDSEKDIFDYIQWKYREPKDRSE
  
Inhibitor
Name:
BDBM50442234
Synonyms:
CHEMBL2442004
Type:
Small organic molecule
Emp. Form.:
C24H23NO5
Mol. Mass.:
405.4431
SMILES:
CCOC(=O)C(=O)CC(=O)C=Cc1cn(Cc2ccc(OC)cc2)c2ccccc12 |w:11.11|
Structure:
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