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Target
Protease
Ligand
BDBM50261426
Substrate
n/a
Meas. Tech.
ChEMBL_533037 (CHEMBL993243)
IC50
80.4±n/a nM
Citation
 Zhang, M; Nguyen, JT; Kumada, HO; Kimura, T; Cheng, M; Hayashi, Y; Kiso, Y Synthesis and activity of tetrapeptidic HTLV-I protease inhibitors possessing different P3-cap moieties. Bioorg Med Chem 16:5795-802 (2008) [PubMed]  Article 
Target
Name:
Protease
Synonyms:
n/a
Type:
PROTEIN
Mol. Mass.:
18047.65
Organism:
Human T-lymphotropic virus 1
Description:
ChEMBL_533037
Residue:
166
Sequence:
MTVLPIALFSSNTPLRNTSVLGAGGQTQDHFKLTSLPVLIRLPFRTTPIVLTSCLVDTKNNWAIIGRDALQQCQGALYLPEAKGPPVILPIQAPAVLGLEHLPRPPEISQFPLNQNGSRPCNTWSGRPWRQAISNPTPGQEITQYSQLKRPMEPGDSSTTCGPLTL
  
Inhibitor
Name:
BDBM50261426
Synonyms:
(R)-N-Isobutyl-3-{{(2S,3S)-3-{(2S)-2-[(2S)-2-(2,2-dimethyl)butanoylamino-2-phenyl]acetylamino-3,3-dimethyl}butanoylamino-2-hydroxy-4-phenyl}}butanoyl-5,5-dimethyl-1,3-thiazolidine-4-carboxamide | CHEMBL448822 | KNI-10614
Type:
Small organic molecule
Emp. Form.:
C40H59N5O6S
Mol. Mass.:
737.991
SMILES:
CCC(C)(C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)[C@H](O)C(=O)N1CSC(C)(C)[C@H]1C(=O)NCC(C)C)C(C)(C)C)c1ccccc1 |r|
Structure:
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