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Target
Reverse transcriptase
Ligand
BDBM50467331
Substrate
n/a
Meas. Tech.
ChEMBL_1795816 (CHEMBL4267933)
IC50
30±n/a nM
Citation
 Gu, SX; Lu, HH; Liu, GY; Ju, XL; Zhu, YY Advances in diarylpyrimidines and related analogues as HIV-1 nonnucleoside reverse transcriptase inhibitors. Eur J Med Chem 158:371-392 (2018) [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:
BDBM50467331
Synonyms:
CHEMBL72242
Type:
Small organic molecule
Emp. Form.:
C22H18N6O2
Mol. Mass.:
398.4173
SMILES:
CC(=O)Nc1cnc(Nc2ccc(cc2)C#N)nc1Oc1c(C)cc(cc1C)C#N
Structure:
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