Drug Information
Drug General Information | Top | |||
---|---|---|---|---|
Drug ID |
D0G3IT
|
|||
Former ID |
DNC010810
|
|||
Drug Name |
RU-56187
|
|||
Synonyms |
RU-56187; 143782-25-6; CHEMBL1099140; 4-(3,4,4-Trimethyl-5-oxo-2-thioxo-1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile; Benzonitrile,2-(trifluoromethyl)-4-(3,4,4-trimethyl-5-oxo-2-thioxo-1-imidazolidinyl)-; RU 56187; ACMC-20n377; AC1L318J; SCHEMBL1435262; CTK4C3806; DTXSID90162545; BDBM50317664; 2-(trifluoromethyl)-4-(3,4,4-trimethyl-5-oxo-2-sulfanylideneimidazolidin-1-yl)benzonitrile; 2-(trifluoromethyl)-4-(3,4,4-trimethyl-5-oxo-2-thioxoimidazolidin-1-yl)benzonitrile; Benzonitrile, 2-(trifluoromethyl)-4-(3,4,4-trimet
Click to Show/Hide
|
|||
Drug Type |
Small molecular drug
|
|||
Indication | Discovery agent [ICD-11: N.A.] | Investigative | [1] | |
Structure |
Download2D MOL |
|||
Formula |
C14H12F3N3OS
|
|||
Canonical SMILES |
CC1(C(=O)N(C(=S)N1C)C2=CC(=C(C=C2)C#N)C(F)(F)F)C
|
|||
InChI |
1S/C14H12F3N3OS/c1-13(2)11(21)20(12(22)19(13)3)9-5-4-8(7-18)10(6-9)14(15,16)17/h4-6H,1-3H3
|
|||
InChIKey |
HLBUAKQNKJTEIU-UHFFFAOYSA-N
|
|||
CAS Number |
CAS 143782-25-6
|
|||
PubChem Compound ID |
Target and Pathway | Top | |||
---|---|---|---|---|
Target(s) | Androgen receptor messenger RNA (AR mRNA) | Target Info | Inhibitor | [1] |
KEGG Pathway | Oocyte meiosis | |||
Pathways in cancer | ||||
Prostate cancer | ||||
NetPath Pathway | EGFR1 Signaling Pathway | |||
AndrogenReceptor Signaling Pathway | ||||
FSH Signaling Pathway | ||||
Pathway Interaction Database | Regulation of nuclear SMAD2/3 signaling | |||
Coregulation of Androgen receptor activity | ||||
Regulation of Androgen receptor activity | ||||
Nongenotropic Androgen signaling | ||||
Regulation of nuclear beta catenin signaling and target gene transcription | ||||
FOXA1 transcription factor network | ||||
Notch-mediated HES/HEY network | ||||
Reactome | Nuclear Receptor transcription pathway | |||
Activated PKN1 stimulates transcription of AR (androgen receptor) regulated genes KLK2 and KLK3 | ||||
WikiPathways | SIDS Susceptibility Pathways | |||
Integrated Pancreatic Cancer Pathway | ||||
Prostate Cancer | ||||
Integrated Breast Cancer Pathway | ||||
Nuclear Receptors | ||||
Androgen receptor signaling pathway |
References | Top | |||
---|---|---|---|---|
REF 1 | Structure-activity relationships of bioisosteric replacement of the carboxylic acid in novel androgen receptor pure antagonists. Bioorg Med Chem. 2010 May 1;18(9):3159-68. |
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.