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SMILES: CN(CC#C)Cc1ccc(Cc2cn(C)nn2)cc1

InChI Key: InChIKey=FTYCTGZWJXCXGA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50536264   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50536264
PNG
(CHEMBL4592550)
Show SMILES CN(CC#C)Cc1ccc(Cc2cn(C)nn2)cc1
Show InChI InChI=1S/C15H18N4/c1-4-9-18(2)11-14-7-5-13(6-8-14)10-15-12-19(3)17-16-15/h1,5-8,12H,9-11H2,2-3H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 600n/an/an/an/an/an/a



Universitat de Barcelona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAO-B preincubated for 30 mins followed by p-tyramine hydrochloride addition measured after 30 mins by Amplex red flu...


Bioorg Med Chem 24: 4835-4854 (2016)


Article DOI: 10.1016/j.bmc.2016.06.045
BindingDB Entry DOI: 10.7270/Q2028W20
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50536264
PNG
(CHEMBL4592550)
Show SMILES CN(CC#C)Cc1ccc(Cc2cn(C)nn2)cc1
Show InChI InChI=1S/C15H18N4/c1-4-9-18(2)11-14-7-5-13(6-8-14)10-15-12-19(3)17-16-15/h1,5-8,12H,9-11H2,2-3H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 500n/an/an/an/an/an/a



Universitat de Barcelona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAO-A preincubated for 30 mins followed by p-tyramine hydrochloride addition measured after 30 mins by Amplex red flu...


Bioorg Med Chem 24: 4835-4854 (2016)


Article DOI: 10.1016/j.bmc.2016.06.045
BindingDB Entry DOI: 10.7270/Q2028W20
More data for this
Ligand-Target Pair