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Target
DNA polymerase beta
Ligand
BDBM50292441
Substrate
n/a
Meas. Tech.
ChEMBL_546495 (CHEMBL1026664)
IC50
2200±n/a nM
Citation
 Pengsuparp, T; Cai, L; Constant, H; Fong, HH; Lin, LZ; Kinghorn, AD; Pezzuto, JM; Cordell, GA; Ingolfsdöttir, K; Wagner, H; Hughes, SH Mechanistic Evaluation of New Plant-Derived Compounds That Inhibit HIV-1 Reverse Transcriptase J Nat Prod 58:1024-1031 (1995) [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:
BDBM50292441
Synonyms:
1beta-hydroxyaleuritolic acid 3-p-hydroxybenzoate | 1beta-hydroxyaleuritolic acid-3-p-hydroxybenzoate | CHEMBL454727
Type:
Small organic molecule
Emp. Form.:
C37H52O6
Mol. Mass.:
592.8052
SMILES:
CC1(C)CC[C@@]2(CC=C3[C@]4(C)CC[C@H]5C(C)(C)[C@H](C[C@@H](O)[C@]5(C)[C@H]4CC[C@@]3(C)[C@H]2C1)OC(=O)c1ccc(O)cc1)C(O)=O |r,t:7|
Structure:
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