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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Monoamine oxidase' and Ligand = 'BDBM50304153'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Monoamine oxidase


(Rattus norvegicus (rat))
BDBM50304153
PNG
(3-(2-Furyl)-2-(N-methylthiocarbamoyl)-3,3a,4,5,6,7...)
Show SMILES CNC(=S)N1N=C2CCCCC2C1c1ccco1
Show InChI InChI=1/C13H17N3OS/c1-14-13(18)16-12(11-7-4-8-17-11)9-5-2-3-6-10(9)15-16/h4,7-9,12H,2-3,5-6H2,1H3,(H,14,18)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
8.82E+3n/an/an/an/an/an/an/an/a



Hacettepe University

Curated by ChEMBL


Assay Description
Competitive inhibition of MAOA in rat liver homogenate by spectrophotometrically


Bioorg Med Chem 17: 6761-72 (2009)


Article DOI: 10.1016/j.bmc.2009.07.033
BindingDB Entry DOI: 10.7270/Q2TQ61M2
More data for this
Ligand-Target Pair
Monoamine oxidase


(Rattus norvegicus (rat))
BDBM50304153
PNG
(3-(2-Furyl)-2-(N-methylthiocarbamoyl)-3,3a,4,5,6,7...)
Show SMILES CNC(=S)N1N=C2CCCCC2C1c1ccco1
Show InChI InChI=1/C13H17N3OS/c1-14-13(18)16-12(11-7-4-8-17-11)9-5-2-3-6-10(9)15-16/h4,7-9,12H,2-3,5-6H2,1H3,(H,14,18)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.08E+5n/an/an/an/an/an/a



Hacettepe University

Curated by ChEMBL


Assay Description
Competitive inhibition of MAOA in rat liver homogenate by spectrophotometrically


Bioorg Med Chem 17: 6761-72 (2009)


Article DOI: 10.1016/j.bmc.2009.07.033
BindingDB Entry DOI: 10.7270/Q2TQ61M2
More data for this
Ligand-Target Pair