Molecule Details
InChIKeyATGDFHAACSGXGG-OUIFVKKZSA-N
Compound Name2-(tert-butoxycarbonylamino)ethyl N-[(1S,2R)-3-[1,3-benzothiazol-6-ylsulfonyl-[(2S)-2-methylbutyl]amino]-1-benzyl-2-hydroxy-propyl]carbamate
Canonical SMILESCC[C@H](C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OCCNC(=O)OC(C)(C)C)S(=O)(=O)c1ccc2ncsc2c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL9.07
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (2)
Target Gene Organism Category Pfam pChEMBL Type Source
Q9YQ12 protease Human immunodeficiency virus type 1 Pathogen PF00077 9.6 Ki ChEMBL;BindingDB
Q72874 pol Human immunodeficiency virus type 1 Pathogen PF00077 8.5 Ki ChEMBL