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BDBM50075996 CHEMBL3415611

SMILES: OC(=O)C([O-])=O.Fc1cccc(COc2cccc(c2)C(=C)C[NH2+]CC#C)c1

InChI Key: InChIKey=UWBBITNCTHTQIE-UHFFFAOYSA-O

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50075996   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Amine oxidase (flavin-containing) A


(Homo sapiens (Human))
BDBM50075996
PNG
(CHEMBL3415611)
Show SMILES Fc1cccc(COc2cccc(c2)C(=C)C[NH2+]CC#C)c1
Show InChI InChI=1S/C19H18FNO/c1-3-10-21-13-15(2)17-7-5-9-19(12-17)22-14-16-6-4-8-18(20)11-16/h1,4-9,11-12,21H,2,10,13-14H2/p+1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 1.90n/an/an/an/an/an/a



A* STAR

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAO-A expressed in Sf9 cells using 5-hydroxytryptamine substrate assessed as hydrogen peroxide production after 1 hr ...


J Med Chem 58: 1400-19 (2015)


Article DOI: 10.1021/jm501722s
BindingDB Entry DOI: 10.7270/Q2V989R3
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50075996
PNG
(CHEMBL3415611)
Show SMILES Fc1cccc(COc2cccc(c2)C(=C)C[NH2+]CC#C)c1
Show InChI InChI=1S/C19H18FNO/c1-3-10-21-13-15(2)17-7-5-9-19(12-17)22-14-16-6-4-8-18(20)11-16/h1,4-9,11-12,21H,2,10,13-14H2/p+1
PDB

Reactome pathway

UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.20E+3n/an/an/an/an/an/a



A* STAR

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAO-B expressed in Sf9 cells using 5-phenylacetaldehyde substrate assessed as hydrogen peroxide production after 1 hr...


J Med Chem 58: 1400-19 (2015)


Article DOI: 10.1021/jm501722s
BindingDB Entry DOI: 10.7270/Q2V989R3
More data for this
Ligand-Target Pair