Molecule Details
InChIKeySVOXYTTZYOSESO-YDPTYEFTSA-N
Compound Name4-[[[2-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-6-aminohexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]-1,3-benzothiazole-6-carbonyl]amino]methyl]benzoic acid
Canonical SMILESCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)c1nc2ccc(C(=O)NCc3ccc(C(=O)O)cc3)cc2s1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)4
Pfam Stratification Homologous
Avg pChEMBL8.44
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (4)
Target Gene Organism Category Pfam pChEMBL Type Source
P05981 HPN Homo sapiens Human PF09272 PF00089 9.2 Ki ChEMBL;BindingDB
Q9Y5Y6 ST14 Homo sapiens Human PF00431 PF00057 PF01390 PF00089 8.6 Ki ChEMBL;BindingDB
Q04756 HGFAC Homo sapiens Human PF00008 PF00040 PF00051 PF00089 8.4 Ki ChEMBL;BindingDB
P00742 F10 Homo sapiens Human PF00008 PF14670 PF00594 PF00089 7.5 Ki ChEMBL;BindingDB