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BDBM50307365 (+/-)-2-(4'-Methoxyphenyl)thiomorpholine::CHEMBL598395

SMILES: COc1ccc(cc1)C1CNCCS1

InChI Key: InChIKey=YAPWTYUHWOWUHY-UHFFFAOYSA-N

Data: 4 KI

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 4 hits for monomerid = 50307365   
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))
BDBM50307365
PNG
((+/-)-2-(4'-Methoxyphenyl)thiomorpholine | CHEMBL5...)
Show SMILES COc1ccc(cc1)C1CNCCS1
Show InChI InChI=1S/C11H15NOS/c1-13-10-4-2-9(3-5-10)11-8-12-6-7-14-11/h2-5,11-12H,6-8H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
MCE
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PC sid
UniChem

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Article
PubMed
3.85E+3n/an/an/an/an/an/an/an/a



University of Chile

Curated by ChEMBL


Assay Description
Inhibition of MAOB in rat brain mitochondrial suspension


Bioorg Med Chem 18: 1388-95 (2010)


Article DOI: 10.1016/j.bmc.2010.01.029
BindingDB Entry DOI: 10.7270/Q2T72JD7
More data for this
Ligand-Target Pair
Monoamine oxidase


(Rattus norvegicus (rat))
BDBM50307365
PNG
((+/-)-2-(4'-Methoxyphenyl)thiomorpholine | CHEMBL5...)
Show SMILES COc1ccc(cc1)C1CNCCS1
Show InChI InChI=1S/C11H15NOS/c1-13-10-4-2-9(3-5-10)11-8-12-6-7-14-11/h2-5,11-12H,6-8H2,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
6.39E+3n/an/an/an/an/an/an/an/a



University of Chile

Curated by ChEMBL


Assay Description
Inhibition of MAOA in rat brain mitochondrial suspension


Bioorg Med Chem 18: 1388-95 (2010)


Article DOI: 10.1016/j.bmc.2010.01.029
BindingDB Entry DOI: 10.7270/Q2T72JD7
More data for this
Ligand-Target Pair
Amine oxidase (flavin-containing) A


(Homo sapiens (Human))
BDBM50307365
PNG
((+/-)-2-(4'-Methoxyphenyl)thiomorpholine | CHEMBL5...)
Show SMILES COc1ccc(cc1)C1CNCCS1
Show InChI InChI=1S/C11H15NOS/c1-13-10-4-2-9(3-5-10)11-8-12-6-7-14-11/h2-5,11-12H,6-8H2,1H3
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
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CHEMBL
MCE
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
1.62E+4n/an/an/an/an/an/an/an/a



University of Chile

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOA by spectrophotometrically


Bioorg Med Chem 18: 1388-95 (2010)


Article DOI: 10.1016/j.bmc.2010.01.029
BindingDB Entry DOI: 10.7270/Q2T72JD7
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50307365
PNG
((+/-)-2-(4'-Methoxyphenyl)thiomorpholine | CHEMBL5...)
Show SMILES COc1ccc(cc1)C1CNCCS1
Show InChI InChI=1S/C11H15NOS/c1-13-10-4-2-9(3-5-10)11-8-12-6-7-14-11/h2-5,11-12H,6-8H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents


Similars

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



University of Chile

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB by spectrophotometrically


Bioorg Med Chem 18: 1388-95 (2010)


Article DOI: 10.1016/j.bmc.2010.01.029
BindingDB Entry DOI: 10.7270/Q2T72JD7
More data for this
Ligand-Target Pair