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BDBM50049693 6-(4,5-Dihydro-1H-imidazol-2-yl)-2-isopropyl-10,10-dioxo-10H-10lambda*6*-thioxanthen-9-one::CHEMBL55947

SMILES: CC(C)c1ccc2c(c1)C(=O)c1ccc(cc1S2(=O)=O)C1=NCCN1

InChI Key: InChIKey=NXDLHDKFKUJAIL-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50049693   
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
Monoamine oxidase


(Rattus norvegicus (rat))
BDBM50049693
PNG
(6-(4,5-Dihydro-1H-imidazol-2-yl)-2-isopropyl-10,10...)
Show SMILES CC(C)c1ccc2c(c1)C(=O)c1ccc(cc1S2(=O)=O)C1=NCCN1 |t:23|
Show InChI InChI=1S/C19H18N2O3S/c1-11(2)12-4-6-16-15(9-12)18(22)14-5-3-13(19-20-7-8-21-19)10-17(14)25(16,23)24/h3-6,9-11H,7-8H2,1-2H3,(H,20,21)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 50n/an/an/an/an/an/a



Wellcome Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory concentration against rat brain mitochondrial monoamine oxidase A


J Med Chem 39: 1857-63 (1996)


Article DOI: 10.1021/jm950595m
BindingDB Entry DOI: 10.7270/Q2TM796B
More data for this
Ligand-Target Pair