Showing entry for 2-Aminoquinoline


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0006109
Compound Name2-Aminoquinoline
Structure
FormulaC9H8N2
InchiKeyGCMNJUJAKQGROZ-UHFFFAOYSA-N
SMILESNC1=NC2=C(C=CC=C2)C=C1
InchiInChI=1S/C9H8N2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H,(H2,10,11)
IUPACquinolin-2-amine
Molecular Weight144.17
Pubchem Id11379
Chembl IdCHEMBL61236
Targets of Information Source
DrugBank n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
PDB 2AQ
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
P56817 BXGT011200 Beta-secretase 1 reviewed BACE1 Enzyme - - - -
O34453 BXGT004478 Nitric oxide synthase oxygenase reviewed nos - - - - -
Binding DB 14322
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
reviewed BXGT013588 Tryptase alpha/beta-1 reviewed TPSAB1 220000 - - -
reviewed BXGT008550 Tryptase beta-2 reviewed TPSB2 220000 - - -
reviewed BXGT005644 Cationic trypsin reviewed - 560000 - - -
reviewed BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 - 2000000 - -
reviewed BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 - - - -
reviewed BXGT009849 5-hydroxytryptamine receptor 3A reviewed Htr3a 1000 - - -
reviewed BXGT009800 Nitric oxide synthase, inducible reviewed NOS2 - 1700 - -
reviewed BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 - - 900000 -
reviewed BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 - 800000 - -
reviewed BXGT008219 Cytoplasmic protein NCK1 reviewed NCK1 - - - 150000
reviewed BXGT006801 Tyrosine-protein kinase HCK reviewed Kinase HCK - - - >1000000
reviewed BXGT008059 5-hydroxytryptamine receptor 2A reviewed Htr2a 79000 - - -
CHEMBL CHEMBL61236
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
P05227 BXGT006343 Histidine-rich protein PFHRP-II reviewed - NI - - -
P08631 BXGT006801 Tyrosine-protein kinase HCK reviewed Kinase HCK EC50 '>' 1000000 nM
P56817 BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 IC50 '=' 2000000 nM
Q8CFK4 BXGT017932 Tyrosine-protein kinase unreviewed - Tec Kd '=' 125000 nM
P56817 BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 Kd '=' 900000 nM
P35228 BXGT009800 Nitric oxide synthase, inducible reviewed - NOS2 IC50 '=' 1700 nM
P29474 BXGT009352 Nitric oxide synthase, endothelial reviewed - NOS3 IC50 - - -
P29474 BXGT009352 Nitric oxide synthase, endothelial reviewed - NOS3 Selectivity - - -
P35228 BXGT009800 Nitric oxide synthase, inducible reviewed - NOS2 Selectivity - - -
P56817 BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 Inhibition '=' 30 %
P06241 BXGT006429 Tyrosine-protein kinase Fyn reviewed Kinase FYN EC50 - - -
P29475 BXGT009353 Nitric oxide synthase, brain reviewed - NOS1 IC50 - - -
P29475 BXGT009353 Nitric oxide synthase, brain reviewed - NOS1 Selectivity - - -
P16333 BXGT008219 Cytoplasmic protein NCK1 reviewed - NCK1 EC50 '=' 150000 nM
Q8CFK4 BXGT017932 Tyrosine-protein kinase unreviewed - Tec EC50 '=' 160000 nM
P14842 BXGT008059 5-hydroxytryptamine receptor 2A reviewed - Htr2a Ki '=' 79000 nM
P08909 BXGT006838 5-hydroxytryptamine receptor 2C reviewed - Htr2c Ki '=' 79000 nM
P30994 BXGT009493 5-hydroxytryptamine receptor 2B reviewed - Htr2b Ki '=' 79000 nM
P56817 BXGT011200 Beta-secretase 1 reviewed Enzyme BACE1 IC50 '=' 800000 nM
P84022 BXGT012027 Mothers against decapentaplegic homolog 3 reviewed Transcription factor SMAD3 Potency - 5623 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00805 Mushrooms Vegetables
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease