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Target
Reverse transcriptase
Ligand
BDBM50206060
Substrate
n/a
Meas. Tech.
ChEMBL_642255 (CHEMBL1177074)
IC50
38±n/a nM
Citation
 Younis, Y; Hunter, R; Muhanji, CI; Hale, I; Singh, R; Bailey, CM; Sullivan, TJ; Anderson, KS [d4U]-spacer-[HI-236] double-drug inhibitors of HIV-1 reverse-transcriptase. Bioorg Med Chem 18:4661-73 (2010) [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:
BDBM50206060
Synonyms:
1-(2,5-dimethoxyphenethyl)-3-(5-bromopyridin-2-yl)thiourea | 1-(5-Bromo-pyridin-2-yl)-3-[2-(2,5-dimethoxy-phenyl)-ethyl]-thiourea | 1-(5-bromopyridin-2-yl)-3-(2,5-dimethoxyphenethyl)thiourea | CHEMBL240416 | HI-236
Type:
Small organic molecule
Emp. Form.:
C16H18BrN3O2S
Mol. Mass.:
396.302
SMILES:
COc1ccc(OC)c(CCNC(=S)Nc2ccc(Br)cn2)c1
Structure:
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