Drug Information

Drug General Information
Drug ID
D01DOV
Former ID
DNC013388
Drug Name
(S)-2-Amino-N-cyclopentyl-7-mercaptoheptanamide
Drug Type
Small molecular drug
Indication Discovery agent Investigative [529093]
Structure
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2D MOL

3D MOL
Formula
C12H24N2OS
Canonical SMILES
C1CCC(C1)NC(=O)C(CCCCCS)N
InChI
1S/C12H24N2OS/c13-11(8-2-1-5-9-16)12(15)14-10-6-3-4-7-10/h10-11,16H,1-9,13H2,(H,14,15)/t11-/m0/s1
InChIKey
BNEXTTBMNDFSSZ-NSHDSACASA-N
PubChem Compound ID
23634888
Target and Pathway
Target(s) Histone deacetylase 6 Target Info Inhibitor [529093]
KEGG Pathway Alcoholism
Viral carcinogenesis
Pathway Interaction Database Signaling events mediated by HDAC Class II
Signaling events mediated by HDAC Class I
Reactome NOTCH1 Intracellular Domain Regulates Transcription
Constitutive Signaling by NOTCH1 PEST Domain Mutants
Constitutive Signaling by NOTCH1 HD+PEST Domain Mutants
Assembly of the primary cilium
WikiPathways Ectoderm Differentiation
Neural Crest Differentiation
Cell Cycle
References
Ref 529093J Med Chem. 2007 Nov 1;50(22):5425-38. Epub 2007 Oct 11.Design, synthesis, structure--selectivity relationship, and effect on human cancer cells of a novel series of histone deacetylase 6-selective inhibitors.
Ref 529093J Med Chem. 2007 Nov 1;50(22):5425-38. Epub 2007 Oct 11.Design, synthesis, structure--selectivity relationship, and effect on human cancer cells of a novel series of histone deacetylase 6-selective inhibitors.

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