Reaction Details Report a problem with these data
Target
Reverse transcriptase
Ligand
BDBM50498646
Substrate
n/a
Meas. Tech.
ChEMBL_1518191 (CHEMBL3619838)
IC50
56±n/a nM
Citation
 Gu, SX; Qiao, H; Zhu, YY; Shu, QC; Liu, H; Ju, XL; De Clercq, E; Balzarini, J; Pannecouque, C A novel family of diarylpyrimidines (DAPYs) featuring a diatomic linker: Design, synthesis and anti-HIV activities. Bioorg Med Chem 23:6587-93 (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:
BDBM50498646
Synonyms:
CHEMBL3618320
Type:
Small organic molecule
Emp. Form.:
C18H13F2N5
Mol. Mass.:
337.3261
SMILES:
Fc1ccc(CNc2ccnc(Nc3ccc(cc3)C#N)n2)c(F)c1
Structure:
Search PDB for entries with ligand similarity: