Drug Information

Drug General Information
Drug ID
DXO68O
Drug Name
(3aR,9bS)-7-[(3-Chloro-benzylamino)-methyl]-2,3,3a,9b-tetrahydro-1H-cyclopenta[c]quinolin-4-ylamine
Synonyms
CHEMBL544514
Indication Discovery agent Investigative [1587926]
Formula
C20H24Cl3N3
Canonical SMILES
Cl.Cl.NC1=Nc2cc(CNCc3cccc(Cl)c3)ccc2[C@H]4CCC[C@@H]14
InChI
InChI=1S/C20H22ClN3.2ClH/c21-15-4-1-3-13(9-15)11-23-12-14-7-8-17-16-5-2-6-18(16)20(22)24-19(17)10-14;;/h1,3-4,7-10,16,18,23H,2,5-6,11-12H2,(H2,22,24);2*1H/t16-,18-;;/m1../s1
InChIKey
NUCMQCYPLNGWBS-XMHBETNISA-N
Target and Pathway
Target(s) Nitric-oxide synthase, brain Target Info [1587926]
Nitric oxide synthase, inducible Target Info [1587926]
BioCyc Pathway Citrulline-nitric oxide cyclePWY-4983:Citrulline-nitric oxide cycle
KEGG Pathway Arginine and proline metabolism
Metabolic pathways
Calcium signaling pathway
Phagosome
Circadian entrainment
Long-term depression
Salivary secretion
Alzheimer's disease
Amyotrophic lateral sclerosis (ALS)hsa00220:Arginine biosynthesis
HIF-1 signaling pathway
Peroxisome
Salmonella infection
Pertussis
Leishmaniasis
Chagas disease (American trypanosomiasis)
Toxoplasmosis
Amoebiasis
Tuberculosis
Pathways in cancer
Small cell lung cancer
NetPath Pathway EGFR1 Signaling PathwayNetPath_13:IL1 Signaling Pathway
IL2 Signaling Pathway
PANTHER Pathway CCKR signaling map ST
Pathway Interaction Database IL12-mediated signaling events
Alpha9 beta1 integrin signaling events
ATF-2 transcription factor network
IL23-mediated signaling events
Signaling mediated by p38-alpha and p38-beta
HIF-1-alpha transcription factor network
PathWhiz Pathway Arginine and Proline Metabolism
Reactome ROS production in response to bacteria
Nitric oxide stimulates guanylate cyclaseR-HSA-1222556:ROS production in response to bacteria
Nitric oxide stimulates guanylate cyclase
WikiPathways Monoamine Transport
Myometrial Relaxation and Contraction Pathways
Amyotrophic lateral sclerosis (ALS)
Quercetin and Nf-kB/ AP-1 Induced Cell Apoptosis
Spinal Cord Injury
Alzheimers Disease
Effects of Nitric Oxide
Serotonin Transporter ActivityWP619:Type II interferon signaling (IFNG)
AGE/RAGE pathway
References
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017
Ref 1587926URL: https://www.ebi.ac.uk/chembl/ The ChEMBL database in 2017

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