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BDBM29201 3-carboxamido coumarin, 51

SMILES: O=C(NNc1ccccc1)c1cc2ccc(OCc3ccccc3)cc2oc1=O

InChI Key: InChIKey=OSWDDFNVOXEAGK-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 29201   
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] B


(Homo sapiens (Human))
BDBM29201
PNG
(3-carboxamido coumarin, 51)
Show SMILES O=C(NNc1ccccc1)c1cc2ccc(OCc3ccccc3)cc2oc1=O
Show InChI InChI=1S/C23H18N2O4/c26-22(25-24-18-9-5-2-6-10-18)20-13-17-11-12-19(14-21(17)29-23(20)27)28-15-16-7-3-1-4-8-16/h1-14,24H,15H2,(H,25,26)
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.52E+3n/an/an/an/an/an/a



Sapienza University of Rome



Assay Description
The effects of the test compounds on hMAO isoform enzymatic activity were evaluated by measuring their effects on the production of hydrogen peroxide...


J Med Chem 52: 1935-42 (2009)


Article DOI: 10.1021/jm801496u
BindingDB Entry DOI: 10.7270/Q2SF2THN
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM29201
PNG
(3-carboxamido coumarin, 51)
Show SMILES O=C(NNc1ccccc1)c1cc2ccc(OCc3ccccc3)cc2oc1=O
Show InChI InChI=1S/C23H18N2O4/c26-22(25-24-18-9-5-2-6-10-18)20-13-17-11-12-19(14-21(17)29-23(20)27)28-15-16-7-3-1-4-8-16/h1-14,24H,15H2,(H,25,26)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.14E+4n/an/an/an/an/an/a



Sapienza University of Rome



Assay Description
The effects of the test compounds on hMAO isoform enzymatic activity were evaluated by measuring their effects on the production of hydrogen peroxide...


J Med Chem 52: 1935-42 (2009)


Article DOI: 10.1021/jm801496u
BindingDB Entry DOI: 10.7270/Q2SF2THN
More data for this
Ligand-Target Pair