Reaction Details Report a problem with these data
Target
Reverse transcriptase
Ligand
BDBM50134210
Substrate
n/a
Meas. Tech.
ChEMBL_1542247
IC50
3.3±n/a nM
Citation
 Gray, WT; Frey, KM; Laskey, SB; Mislak, AC; Spasov, KA; Lee, WG; Bollini, M; Siliciano, RF; Jorgensen, WL; Anderson, KS Potent Inhibitors Active against HIV Reverse Transcriptase with K101P, a Mutation Conferring Rilpivirine Resistance. ACS Med Chem Lett 6:1075-9 (2015) [PubMed]  Article  BDB Entry
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:
BDBM50134210
Synonyms:
CHEMBL3342966
Type:
Small organic molecule
Emp. Form.:
C21H16ClN3O4
Mol. Mass.:
409.822
SMILES:
Clc1cc(Oc2ccccc2OCCn2ccc(=O)[nH]c2=O)cc(\C=C\C#N)c1
Structure:
Search PDB for entries with ligand similarity: