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Target
DNA polymerase beta
Ligand
BDBM50164648
Substrate
n/a
Meas. Tech.
ChEMBL_1661124 (CHEMBL4010736)
IC50
1400±n/a nM
Citation
 Kirschberg, TA; Metobo, S; Clarke, MO; Aktoudianakis, V; Babusis, D; Barauskas, O; Birkus, G; Butler, T; Byun, D; Chin, G; Doerffler, E; Edwards, TE; Fenaux, M; Lee, R; Lew, W; Mish, MR; Murakami, E; Park, Y; Squires, NH; Tirunagari, N; Wang, T; Whitcomb, M; Xu, J; Yang, H; Ye, H; Zhang, L; Appleby, TC; Feng, JY; Ray, AS; Cho, A; Kim, CU Discovery of a 2'-fluoro-2'-C-methyl C-nucleotide HCV polymerase inhibitor and a phosphoramidate prodrug with favorable properties. Bioorg Med Chem Lett 27:1840-1847 (2017) [PubMed]  Article 
Target
Name:
DNA polymerase beta
Synonyms:
DNA polymerase beta (Pol β) | DPOLB_HUMAN | POLB
Type:
Protein
Mol. Mass.:
38188.76
Organism:
Human
Description:
n/a
Residue:
335
Sequence:
MSKRKAPQETLNGGITDMLTELANFEKNVSQAIHKYNAYRKAASVIAKYPHKIKSGAEAKKLPGVGTKIAEKIDEFLATGKLRKLEKIRQDDTSSSINFLTRVSGIGPSAARKFVDEGIKTLEDLRKNEDKLNHHQRIGLKYFGDFEKRIPREEMLQMQDIVLNEVKKVDSEYIATVCGSFRRGAESSGDMDVLLTHPSFTSESTKQPKLLHQVVEQLQKVHFITDTLSKGETKFMGVCQLPSKNDEKEYPHRRIDIRLIPKDQYYCGVLYFTGSDIFNKNMRAHALEKGFTINEYTIRPLGVTGVAGEPLPVDSEKDIFDYIQWKYREPKDRSE
  
Inhibitor
Name:
BDBM50164648
Synonyms:
thymidine 5'-(tetrahydrogen triphosphate) | dTTP | 2'-deoxythymidine triphosphate | 5'-TTP | dThd5'PPP | deoxy-TTP | pppdT | thymidine 5'-triphosphate | CHEMBL363559
Type:
Small organic molecule
Emp. Form.:
n/a
Mol. Mass.:
n/a
SMILES:
CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO[P@](=O)(O)O[P@@](=O)(O)OP(=O)(O)O)O
Structure:
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