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Target
Reverse transcriptase
Ligand
BDBM1885
Substrate
n/a
Meas. Tech.
ChEMBL_718271 (CHEMBL1679575)
IC50
15±n/a nM
Citation
 Brandt, P; Geitmann, M; Danielson, UH Deconstruction of non-nucleoside reverse transcriptase inhibitors of human immunodeficiency virus type 1 for exploration of the optimization landscape of fragments. J Med Chem 54:709-18 (2011) [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:
BDBM1885
Synonyms:
3-(5-bromopyridin-2-yl)-1-(2-phenylethyl)thiourea | CHEMBL317356 | N-(2-Phenethyl)-N -(2-(5-bromopyridyl))thiourea | PETT Analog 52 | cid_2429552
Type:
Small organic molecule
Emp. Form.:
C14H14BrN3S
Mol. Mass.:
336.25
SMILES:
Brc1ccc(NC(=S)NCCc2ccccc2)nc1
Structure:
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