Reaction Details Report a problem with these data
Target
Reverse transcriptase
Ligand
BDBM50498753
Substrate
n/a
Meas. Tech.
ChEMBL_1522234 (CHEMBL3626463)
IC50
1840±n/a nM
Citation
 Wan, ZY; Yao, J; Mao, TQ; Wang, XL; Wang, HF; Chen, WX; Yin, H; Chen, FE; De Clercq, E; Daelemans, D; Pannecouque, C Pyrimidine sulfonylacetanilides with improved potency against key mutant viruses of HIV-1 by specific targeting of a highly conserved residue. Eur J Med Chem 102:215-22 (2015) [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:
BDBM50498753
Synonyms:
CHEMBL3621384
Type:
Small organic molecule
Emp. Form.:
C21H17FN4O4S
Mol. Mass.:
440.447
SMILES:
Cc1cc(cc(C)c1Oc1ccnc(n1)S(=O)(=O)CC(=O)Nc1ccc(F)cc1)C#N
Structure:
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