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BDBM50299444 1-{7-[(3-Chlorobenzyl)oxy]-2-oxo-2H-chromen-4-yl}prolinamide::CHEMBL575732

SMILES: NC(=O)[C@@H]1CCCN1c1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12

InChI Key: InChIKey=QJWPAVVFJOUUOW-KRWDZBQOSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50299444   
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 Type B (MAO-B)


(Rattus norvegicus (rat))
BDBM50299444
PNG
(1-{7-[(3-Chlorobenzyl)oxy]-2-oxo-2H-chromen-4-yl}p...)
Show SMILES NC(=O)[C@@H]1CCCN1c1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12 |r|
Show InChI InChI=1S/C21H19ClN2O4/c22-14-4-1-3-13(9-14)12-27-15-6-7-16-18(11-20(25)28-19(16)10-15)24-8-2-5-17(24)21(23)26/h1,3-4,6-7,9-11,17H,2,5,8,12H2,(H2,23,26)/t17-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.60E+3n/an/an/an/an/an/a



Universita degli Studi di Bari

Curated by ChEMBL


Assay Description
Inhibition of MAO-B from Wistar rat brain by radioenzymatic assay


J Med Chem 52: 6685-706 (2009)


Article DOI: 10.1021/jm9010127
BindingDB Entry DOI: 10.7270/Q2DR2VJ6
More data for this
Ligand-Target Pair