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BDBM50299420 CHEMBL575907::N2-{7-[(3-Chlorobenzyl)oxy]-2-oxo-2H-chromen-4-yl}serinamide

SMILES: NC(=O)[C@H](CO)Nc1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12

InChI Key: InChIKey=QOPOGAULTUZVEO-INIZCTEOSA-N

Data: 2 IC50

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

Found 2 hits for monomerid = 50299420   
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))
BDBM50299420
PNG
(CHEMBL575907 | N2-{7-[(3-Chlorobenzyl)oxy]-2-oxo-2...)
Show SMILES NC(=O)[C@H](CO)Nc1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12 |r|
Show InChI InChI=1S/C19H17ClN2O5/c20-12-3-1-2-11(6-12)10-26-13-4-5-14-15(22-16(9-23)19(21)25)8-18(24)27-17(14)7-13/h1-8,16,22-23H,9-10H2,(H2,21,25)/t16-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.40E+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
Monoamine oxidase


(Rattus norvegicus (rat))
BDBM50299420
PNG
(CHEMBL575907 | N2-{7-[(3-Chlorobenzyl)oxy]-2-oxo-2...)
Show SMILES NC(=O)[C@H](CO)Nc1cc(=O)oc2cc(OCc3cccc(Cl)c3)ccc12 |r|
Show InChI InChI=1S/C19H17ClN2O5/c20-12-3-1-2-11(6-12)10-26-13-4-5-14-15(22-16(9-23)19(21)25)8-18(24)27-17(14)7-13/h1-8,16,22-23H,9-10H2,(H2,21,25)/t16-/m0/s1
PDB
MMDB

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>1.00E+5n/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