Drug Information
Drug General Information | |||||
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Drug ID |
D0X3DK
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Former ID |
DNC007022
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Drug Name |
KSP-BCS-1-alpha-CHF2-1624F2-2
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Drug Type |
Small molecular drug
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Indication | Discovery agent | Investigative | [1] | ||
Structure |
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Download2D MOL |
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Formula |
C30H44F4O2
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Canonical SMILES |
CCC(CC)(C(CCC(C)C1=CCC2C1(CCCC2=CC=C3CC(CC(C3=C)C(F)F)O<br />)C)(F)F)O
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InChI |
1S/C30H44F4O2/c1-6-29(36,7-2)30(33,34)16-14-19(3)25-12-13-26-21(9-8-15-28(25,26)5)10-11-22-17-23(35)18-24(20(22)4)27(31)32/h10-12,19,23-24,26-27,35-36H,4,6-9,13-18H2,1-3,5H3/b21-10+,22-11-/t19-,23-,24+,26+,28-/m1/s1
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InChIKey |
CUKDGTJRZFQGCK-HBXJJCJFSA-N
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PubChem Compound ID | |||||
Target and Pathway | |||||
Target(s) | Vitamin D receptor | Target Info | Inhibitor | [1] | |
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 | Ovarian Infertility Genes | ||||
Nuclear Receptors in Lipid Metabolism and Toxicity | |||||
Nuclear Receptors Meta-Pathway | |||||
Vitamin D Receptor Pathway | |||||
Drug Induction of Bile Acid Pathway | |||||
Nuclear Receptors | |||||
Vitamin D Metabolism | |||||
References | |||||
REF 1 | J Med Chem. 2006 Dec 14;49(25):7513-7.Low-calcemic, highly antiproliferative, 1-difluoromethyl hybrid analogs of the natural hormone 1alpha,25-dihydroxyvitamin D3: design, synthesis, and preliminary biological evaluation. | ||||
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