Reaction Details Report a problem with these data
Target
Reverse transcriptase protein
Ligand
BDBM50484495
Substrate
n/a
Meas. Tech.
ChEMBL_792578 (CHEMBL1930122)
Ki
1.5±n/a nM
Citation
 Gomez, R; Jolly, S; Williams, T; Tucker, T; Tynebor, R; Vacca, J; McGaughey, G; Lai, MT; Felock, P; Munshi, V; DeStefano, D; Touch, S; Miller, M; Yan, Y; Sanchez, R; Liang, Y; Paton, B; Wan, BL; Anthony, N Design and synthesis of pyridone inhibitors of non-nucleoside reverse transcriptase. Bioorg Med Chem Lett 21:7344-50 (2011) [PubMed]  Article 
Target
Name:
Reverse transcriptase protein
Synonyms:
Reverse Transcriptase | Reverse Transcriptase (A62V) | Reverse Transcriptase (F61A)
Type:
Protein
Mol. Mass.:
30203.56
Organism:
Human immunodeficiency virus 1
Description:
Q9WJQ2
Residue:
259
Sequence:
PISPIEPVPVKLKPGMDGPKVKQWPLTEEKIKALVEICTEMEKEGKISKIGPENPYNTPVFAIKKKDSTRWRKLVDFRELNKRTQDFWEVQLGIPHPAGLKKKRSVTVLDVGDAYFSVPLDKEFRKYTAFTIPSINNETPGIRYQYNVLPQGWKGSPAIFQSSMTKILEPFRKQNPDIVIYQYMDDLYVGSDLEIGQHRTKIEELRQHLLKWGFTTPDKKHQKEPPFLWMGYEHHPDKWTVQPIVLPEKDSWTVNDIQK
  
Inhibitor
Name:
BDBM50484495
Synonyms:
CHEMBL1928645
Type:
Small organic molecule
Emp. Form.:
C19H11Cl2N5O2
Mol. Mass.:
412.229
SMILES:
Clc1cc(Oc2c(Cl)ccn(Cc3n[nH]c4ncccc34)c2=O)cc(c1)C#N
Structure:
Search PDB for entries with ligand similarity: