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Target
Reverse transcriptase
Ligand
BDBM50479681
Substrate
n/a
Meas. Tech.
ChEMBL_516592 (CHEMBL988679)
KOFF
0.000021 s-1
Citation
 Radi, M; Maga, G; Alongi, M; Angeli, L; Samuele, A; Zanoli, S; Bellucci, L; Tafi, A; Casaluce, G; Giorgi, G; Armand-Ugon, M; Gonzalez, E; Esté, JA; Baltzinger, M; Bec, G; Dumas, P; Ennifar, E; Botta, M Discovery of chiral cyclopropyl dihydro-alkylthio-benzyl-oxopyrimidine (S-DABO) derivatives as potent HIV-1 reverse transcriptase inhibitors with high activity against clinically relevant mutants. J Med Chem 52:840-51 (2009) [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:
BDBM50479681
Synonyms:
CHEMBL478258
Type:
Small organic molecule
Emp. Form.:
C24H24F2N2O2S
Mol. Mass.:
442.521
SMILES:
[H][C@@]1(CSc2nc([C@H](C)c3c(F)cccc3F)c(C)c(=O)[nH]2)C[C@@]1([H])c1ccc(OC)cc1 |r|
Structure:
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