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Target
Reverse transcriptase
Ligand
BDBM50467330
Substrate
n/a
Meas. Tech.
ChEMBL_1795816 (CHEMBL4267933)
IC50
106±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:
BDBM50467330
Synonyms:
CHEMBL307950
Type:
Small organic molecule
Emp. Form.:
C22H21N5
Mol. Mass.:
355.4356
SMILES:
Cc1cc(C)c(Nc2nc(Nc3ccc(cc3)C#N)ncc2C=C)c(C)c1
Structure:
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