Molecule Details
InChIKeyIHXUSNDFXFDCNP-XDIGFQIYSA-N
Compound Name(8S,11S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-6-(ethanethioylamino)-1-oxohexan-2-yl]-8-(1H-imidazol-5-ylmethyl)-6,9-dioxo-2-oxa-7,10-diazabicyclo[11.2.2]heptadeca-1(15),13,16-triene-11-carboxamide
Canonical SMILESCSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCNC(C)=S)NC(=O)[C@@H]1Cc2ccc(cc2)OCCCC(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N1)C(N)=O
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL6.35
SourceChEMBL;BindingDB
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
Q96EB6 SIRT1 Homo sapiens Human PF02146 6.8 IC50 ChEMBL;BindingDB
Q8IXJ6 SIRT2 Homo sapiens Human PF02146 6.2 IC50 ChEMBL;BindingDB
Q9NTG7 SIRT3 Homo sapiens Human PF02146 6.1 IC50 ChEMBL;BindingDB