Molecule Details
InChIKeyVAHZBDOLKHNQEE-HOTGVXAUSA-N
Compound Name2-Acetylamino-4-methyl-pentanoic acid [1-(benzothiazole-2-carbonyl)-4-guanidino-butyl]-amide; TFA
Canonical SMILESCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)c1nc2ccccc2s1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)4
Pfam Stratification Homologous
Avg pChEMBL7.85
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (4)
Target Gene Organism Category Pfam pChEMBL Type Source
P05981 HPN Homo sapiens Human PF09272 PF00089 8.5 Ki ChEMBL
P07477 PRSS1 Homo sapiens Human PF00089 8.2 Ki ChEMBL;BindingDB
P20231 TPSB2 Homo sapiens Human PF00089 7.4 Ki BindingDB
Q15661 TPSAB1 Homo sapiens Human PF00089 7.4 Ki ChEMBL