Drug Information

Drug General Information
Drug ID
D04OVJ
Former ID
DNC003516
Drug Name
Ro-154513
Drug Type
Small molecular drug
Indication Discovery agent Investigative [467635]
Formula
C15H14N6O3
InChI
InChI=1S/C15H14N6O3/c1-3-24-15(23)13-12-7-20(2)14(22)10-6-9(18-19-16)4-5-11(10)21(12)8-17-13/h4-6,8H,3,7H2,1-2H3
InChIKey
CFSOJZTUTOQNIA-UHFFFAOYSA-N
PubChem Compound ID
5081
PubChem Substance ID
7380059, 8153126, 12013972, 14924107, 24899343, 26753182, 29224150, 48110695, 48334739, 49978810, 53790684, 56464704, 56464705, 57322599, 77036011, 91722218, 103164360, 104308223, 125541711, 127618661, 134340721, 134961914, 135062199, 135697913, 162023141, 162228348, 163201388, 177748542, 178101113, 178101180, 184581957, 198958950, 239972838, 241375734, 252156245
Target and Pathway
Target(s) Gamma-aminobutyric acid receptor subunit beta-2 Target Info Inhibitor [534008]
Gamma-aminobutyric-acid receptor alpha-5 subunit Target Info Inhibitor [534122]
Gamma-aminobutyric acid receptor subunit alpha-1 Target Info Inhibitor [534008]
Gamma-aminobutyric acid receptor subunit gamma-2 Target Info Inhibitor [533912]
Gamma-aminobutyric-acid receptor alpha-2 subunit Target Info Inhibitor [534122]
Gamma-aminobutyric acid receptor Target Info Inhibitor [534122]
Gamma-aminobutyric-acid receptor alpha-3 subunit Target Info Inhibitor [534122]
KEGG Pathway Neuroactive ligand-receptor interaction
Retrograde endocannabinoid signaling
Serotonergic synapse
GABAergic synapse
Morphine addiction
Nicotine addictionhsa04080:Neuroactive ligand-receptor interaction
Nicotine addiction
Reactome Ligand-gated ion channel transport
GABA A receptor activationR-HSA-975298:Ligand-gated ion channel transport
GABA A receptor activation
WikiPathways Neurotransmitter Receptor Binding And Downstream Transmission In The Postsynaptic Cell
Iron uptake and transportWP2754:Neurotransmitter Receptor Binding And Downstream Transmission In The Postsynaptic Cell
Iron uptake and transportWP706:SIDS Susceptibility Pathways
Iron uptake and transport
References
Ref 467635(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: 4296).
Ref 533912J Med Chem. 1994 Mar 18;37(6):758-68.Antagonist, partial agonist, and full agonist imidazo[1,5-a]quinoxaline amides and carbamates acting through the GABAA/benzodiazepine receptor.
Ref 534008J Med Chem. 1993 Apr 16;36(8):1001-6.Synthesis and evaluation of imidazo[1,5-a][1,4]benzodiazepine esters with high affinities and selectivities at "diazepam-insensitive" benzodiazepine receptors.
Ref 534122J Med Chem. 1996 Apr 26;39(9):1928-34.Synthesis and pharmacological properties of novel 8-substituted imidazobenzodiazepines: high-affinity, selective probes for alpha 5-containing GABAA receptors.

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