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BDBM50402322 CHEMBL2206101

SMILES: Cn1c(nc2n(C)c(=O)n(C)c(=O)c12)S(=O)Cc1ccccc1

InChI Key: InChIKey=YWZIDBWDMRCUPS-UHFFFAOYNA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50402322   
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] A


(Homo sapiens (Human))
BDBM50402322
PNG
(CHEMBL2206101)
Show SMILES Cn1c(nc2n(C)c(=O)n(C)c(=O)c12)S(=O)Cc1ccccc1
Show InChI InChI=1/C15H16N4O3S/c1-17-11-12(18(2)15(21)19(3)13(11)20)16-14(17)23(22)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.50E+5n/an/an/an/an/an/a



North-West University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAO-A expressed in insect cell microsome assessed as 4-hydroxyquinoline formation using kynuramine as substrate after...


Bioorg Med Chem 20: 7040-50 (2012)


Article DOI: 10.1016/j.bmc.2012.10.005
BindingDB Entry DOI: 10.7270/Q2QZ2C4W
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50402322
PNG
(CHEMBL2206101)
Show SMILES Cn1c(nc2n(C)c(=O)n(C)c(=O)c12)S(=O)Cc1ccccc1
Show InChI InChI=1/C15H16N4O3S/c1-17-11-12(18(2)15(21)19(3)13(11)20)16-14(17)23(22)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.31E+5n/an/an/an/an/an/a



North-West University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAO-B expressed in insect cell microsome assessed as 4-hydroxyquinoline formation using kynuramine as substrate after...


Bioorg Med Chem 20: 7040-50 (2012)


Article DOI: 10.1016/j.bmc.2012.10.005
BindingDB Entry DOI: 10.7270/Q2QZ2C4W
More data for this
Ligand-Target Pair