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Target
Reverse transcriptase
Ligand
BDBM50476397
Substrate
n/a
Meas. Tech.
ChEMBL_446085 (CHEMBL895180)
IC50
20±n/a nM
Citation
 Cullen, MD; Deng, BL; Hartman, TL; Watson, KM; Buckheit, RW; Pannecouque, C; Clercq, ED; Cushman, M Synthesis and biological evaluation of alkenyldiarylmethane HIV-1 non-nucleoside reverse transcriptase inhibitors that possess increased hydrolytic stability. J Med Chem 50:4854-67 (2007) [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:
BDBM50476397
Synonyms:
CHEMBL226735
Type:
Small organic molecule
Emp. Form.:
C26H29NO7
Mol. Mass.:
467.511
SMILES:
COC(=O)CCC\C=C(/c1cc(C)c(OC)c(c1)C(=O)OC)c1cc(C)c2oc(=O)n(C)c2c1
Structure:
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