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Target
Reverse transcriptase
Ligand
BDBM50479392
Substrate
n/a
Meas. Tech.
ChEMBL_559681 (CHEMBL1010079)
IC50
3.8±n/a nM
Citation
 Hunter, R; Younis, Y; Muhanji, CI; Curtin, TL; Naidoo, KJ; Petersen, M; Bailey, CM; Basavapathruni, A; Anderson, KS C-2-aryl O-substituted HI-236 derivatives as non-nucleoside HIV-1 reverse-transcriptase inhibitors. Bioorg Med Chem 16:10270-80 (2008) [PubMed]  Article
Target
Name:
Reverse transcriptase
Synonyms:
n/a
Type:
Protein
Mol. Mass.:
29598.37
Organism:
Human immunodeficiency virus 1
Description:
Q9WKE8
Residue:
254
Sequence:
PISPITVPVKLKPGMDGPKVKQWPLTEEKIKALTEICTEMEKEGKIEKIGPENPYNTPVFAIKKKDSTKWRKVVDFRELNKRTQDFWEVQLGIPHPAGLKKKKSVTVLDVGDAYFSVPLDKDFRKYTAFTIPSINNETPGIRYQYNVLPQGWKGSPAIFQSSMTKILEPFRKQNPDIVIYQYMDDLYVGSDLEIEQHRAKIEELRQHLLRWGFTTPDKKHQKEPPFLWMGYELHPDKWTVQPIVLPEKDSWTVN
  
Inhibitor
Name:
BDBM50479392
Synonyms:
CHEMBL240417
Type:
Small organic molecule
Emp. Form.:
C19H20BrN3O2S
Mol. Mass.:
434.35
SMILES:
COc1ccc(OCCC#C)c(CCNC(=S)Nc2ccc(Br)cn2)c1
Structure:
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