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BDBM50299437 2-[7-(3-Chlorobenzyloxy)-2-oxo-2H-chromen-4-yl]acetohydrazide::CHEMBL573051

SMILES: NNC(=O)Cc1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12

InChI Key: InChIKey=ZRUPQGROZUIXAB-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50299437   
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))
BDBM50299437
PNG
(2-[7-(3-Chlorobenzyloxy)-2-oxo-2H-chromen-4-yl]ace...)
Show SMILES NNC(=O)Cc1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12
Show InChI InChI=1S/C18H15ClN2O4/c19-13-3-1-2-11(6-13)10-24-14-4-5-15-12(7-17(22)21-20)8-18(23)25-16(15)9-14/h1-6,8-9H,7,10,20H2,(H,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 90n/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
Monoamine oxidase


(Rattus norvegicus (rat))
BDBM50299437
PNG
(2-[7-(3-Chlorobenzyloxy)-2-oxo-2H-chromen-4-yl]ace...)
Show SMILES NNC(=O)Cc1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12
Show InChI InChI=1S/C18H15ClN2O4/c19-13-3-1-2-11(6-13)10-24-14-4-5-15-12(7-17(22)21-20)8-18(23)25-16(15)9-14/h1-6,8-9H,7,10,20H2,(H,21,22)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.50E+3n/an/an/an/an/an/a



Universita degli Studi di Bari

Curated by ChEMBL


Assay Description
Inhibition of MAO-A 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