Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
D06RBG
|
||||
| Former ID |
DIB018599
|
||||
| Drug Name |
3-keto-lithocholic acid
|
||||
| Synonyms |
dehydrolithocholic acid; 3-keto-LCA
|
||||
| Drug Type |
Small molecular drug
|
||||
| Indication | Discovery agent | Investigative | [1] | ||
| Structure |
|
Download2D MOL |
|||
| Formula |
C24H38O3
|
||||
| InChI |
InChI=1S/C24H38O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-16,18-21H,4-14H2,1-3H3,(H,26,27)/t15-,16-,18+,19-,20+,21+,23+,24-/m1/s1
|
||||
| InChIKey |
KIQFUORWRVZTHT-OPTMKGCMSA-N
|
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| PubChem Compound ID | |||||
| PubChem Substance ID | |||||
| Target and Pathway | |||||
| Target(s) | Pregnane X receptor | Target Info | Agonist | [2] | |
| Vitamin D receptor | Target Info | Agonist | [3] | ||
| KEGG Pathway | Endocrine and other factor-regulated calcium reabsorption | ||||
| Mineral absorption | |||||
| Tuberculosis | |||||
| NetPath Pathway | IL4 Signaling Pathway | ||||
| PANTHER Pathway | Vitamin D metabolism and pathway | ||||
| Pathway Interaction Database | Regulation of nuclear SMAD2/3 signaling | ||||
| Direct p53 effectors | |||||
| RXR and RAR heterodimerization with other nuclear receptor | |||||
| Retinoic acid receptors-mediated signaling | |||||
| Validated transcriptional targets of deltaNp63 isoforms | |||||
| Validated transcriptional targets of TAp63 isoforms | |||||
| Reactome | Nuclear Receptor transcription pathway | ||||
| WikiPathways | Nuclear Receptors in Lipid Metabolism and Toxicity | ||||
| Nuclear Receptors Meta-Pathway | |||||
| Pregnane X Receptor pathway | |||||
| Drug Induction of Bile Acid Pathway | |||||
| Nuclear ReceptorsWP34:Ovarian Infertility Genes | |||||
| Vitamin D Receptor Pathway | |||||
| Nuclear Receptors | |||||
| Vitamin D Metabolism | |||||
| References | |||||
| REF 1 | (http://www.guidetopharmacology.org/) Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 2766). | ||||
| REF 2 | The nuclear receptor PXR is a lithocholic acid sensor that protects against liver toxicity. Proc Natl Acad Sci U S A. 2001 Mar 13;98(6):3369-74. | ||||
| REF 3 | Vitamin D receptor as an intestinal bile acid sensor. Science. 2002 May 17;296(5571):1313-6. | ||||
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