Molecule Details
InChIKeyVPBQJYJOINDMSD-XZOQPEGZSA-N
Compound Name2-[(2,2-dichloroacetyl)amino]ethyl N-[(1S,2R)-3-[1,3-benzothiazol-6-ylsulfonyl(pentyl)amino]-1-benzyl-2-hydroxy-propyl]carbamate
Canonical SMILESCCCCCN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OCCNC(=O)C(Cl)Cl)S(=O)(=O)c1ccc2ncsc2c1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)2
Pfam Stratification Homologous
Avg pChEMBL10.48
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 12.0 Ki BindingDB
Q72874 pol Human immunodeficiency virus type 1 Pathogen PF00077 9.0 Ki ChEMBL