Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
D0L7HP
|
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| Former ID |
DNC011076
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| Drug Name |
NILTUBACIN
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| Drug Type |
Small molecular drug
|
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| Indication | Discovery agent | Investigative | [1] | ||
| Structure |
|
Download2D MOL |
|||
| Formula |
C41H42N2O7S
|
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| Canonical SMILES |
C1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)NC(=O)CCCCCCC(=O<br />)O)CSC4=NC(=C(O4)C5=CC=CC=C5)C6=CC=CC=C6
|
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| InChI |
1S/C41H42N2O7S/c44-26-28-17-19-29(20-18-28)35-25-34(27-51-41-43-38(30-11-5-3-6-12-30)39(50-41)31-13-7-4-8-14-31)48-40(49-35)32-21-23-33(24-22-32)42-36(45)15-9-1-2-10-16-37(46)47/h3-8,11-14,17-24,34-35,40,44H,1-2,9-10,15-16,25-27H2,(H,42,45)(H,46,47)/t34-,35+,40+/m1/s1
|
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| InChIKey |
WLLKRNCIQXOQHG-YXQOSMAKSA-N
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| PubChem Compound ID | |||||
| Target and Pathway | |||||
| Target(s) | Histone deacetylase 6 | Target Info | Inhibitor | [1] | |
| Histone Deacetylase 8 | Target Info | Inhibitor | [1] | ||
| KEGG Pathway | Alcoholism | ||||
| Viral carcinogenesishsa05034:Alcoholism | |||||
| Viral carcinogenesis | |||||
| PANTHER Pathway | Wnt signaling pathway | ||||
| Pathway Interaction Database | Signaling events mediated by HDAC Class II | ||||
| Signaling events mediated by HDAC Class Ihdac_classi_pathway: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 ciliumR-HSA-2122947:NOTCH1 Intracellular Domain Regulates Transcription | |||||
| HDACs deacetylate histones | |||||
| WikiPathways | Ectoderm Differentiation | ||||
| Neural Crest Differentiation | |||||
| Cell CycleWP2377:Integrated Pancreatic Cancer Pathway | |||||
| Cell Cycle | |||||
| References | |||||
| REF 1 | Nat Chem Biol. 2010 Mar;6(3):238-243. Epub 2010 Feb 7.Chemical phylogenetics of histone deacetylases. | ||||
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