Drug Information

Drug General Information
Drug ID
D00UQF
Former ID
DNC000715
Drug Name
GW4064
Drug Type
Small molecular drug
Indication Discovery agent Investigative [539788]
Structure
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2D MOL

3D MOL
Formula
C28H22Cl3NO4
InChI
InChI=1S/C28H22Cl3NO4/c1-16(2)27-21(26(32-36-27)25-22(29)7-4-8-23(25)30)15-35-20-12-11-18(24(31)14-20)10-9-17-5-3-6-19(13-17)28(33)34/h3-14,16H,15H2,1-2H3,(H,33,34)/b10-9+
InChIKey
BYTNEISLBIENSA-MDZDMXLPSA-N
CAS Number
CAS 20554-84-1
PubChem Compound ID
9893571
PubChem Substance ID
14861350, 17396625, 24178482, 45640503, 49700831, 50112875, 50126503, 52978686, 53788415, 57373706, 85788199, 91613474, 99373529, 103317356, 109693235, 123044252, 123051105, 123055315, 124893353, 126634893, 126671454, 126725963, 134340074, 134346627, 134964474, 135348273, 135650334, 135698645, 135723696, 136340371, 136946511, 140310058, 144116037, 152258794, 160647645, 162009801, 162011659, 162205221, 162248575, 164842065, 165237902, 172649887, 172652246, 174528642, 177749508, 179317068, 184824132, 198952869, 203094954, 204371572
Target and Pathway
Target(s) Bile acid receptor Target Info Binder [535475]
KEGG Pathway Bile secretion
Pathway Interaction Database RXR and RAR heterodimerization with other nuclear receptor
Reactome Recycling of bile acids and salts
PPARA activates gene expression
Endogenous sterols
WikiPathways Nuclear Receptors in Lipid Metabolism and Toxicity
Nuclear Receptors Meta-Pathway
Farnesoid X Receptor Pathway
Drug Induction of Bile Acid Pathway
References
Ref 539788(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: 2743).
Ref 535475Lithocholic acid decreases expression of bile salt export pump through farnesoid X receptor antagonist activity. J Biol Chem. 2002 Aug 30;277(35):31441-7. Epub 2002 Jun 6.

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