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BDBM50348843 CHEMBL1806767

SMILES: Cn1c(OCCOc2ccc(Cl)cc2)nc2n(C)c(=O)n(C)c(=O)c12

InChI Key: InChIKey=XPLFQPMQLCSNFG-UHFFFAOYSA-N

Data: 2 KI  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 4 hits for monomerid = 50348843   
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))
BDBM50348843
PNG
(CHEMBL1806767)
Show SMILES Cn1c(OCCOc2ccc(Cl)cc2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C16H17ClN4O4/c1-19-12-13(20(2)16(23)21(3)14(12)22)18-15(19)25-9-8-24-11-6-4-10(17)5-7-11/h4-7H,8-9H2,1-3H3
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Article
PubMed
130n/an/an/an/an/an/an/an/a



North-West University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB expressed in baculovirus infected insect cell microsomes using kynuramine as substrate assessed as formation of ...


Eur J Med Chem 46: 3474-85 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.014
BindingDB Entry DOI: 10.7270/Q2JH3MJH
More data for this
Ligand-Target Pair
Amine oxidase (flavin-containing) A


(Homo sapiens (Human))
BDBM50348843
PNG
(CHEMBL1806767)
Show SMILES Cn1c(OCCOc2ccc(Cl)cc2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C16H17ClN4O4/c1-19-12-13(20(2)16(23)21(3)14(12)22)18-15(19)25-9-8-24-11-6-4-10(17)5-7-11/h4-7H,8-9H2,1-3H3
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UniProtKB/TrEMBL

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Article
PubMed
640n/an/an/an/an/an/an/an/a



North-West University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA expressed in baculovirus infected insect cell microsomes using kynuramine as substrate assessed as formation of ...


Eur J Med Chem 46: 3474-85 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.014
BindingDB Entry DOI: 10.7270/Q2JH3MJH
More data for this
Ligand-Target Pair
Amine oxidase (flavin-containing) A


(Homo sapiens (Human))
BDBM50348843
PNG
(CHEMBL1806767)
Show SMILES Cn1c(OCCOc2ccc(Cl)cc2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C16H17ClN4O4/c1-19-12-13(20(2)16(23)21(3)14(12)22)18-15(19)25-9-8-24-11-6-4-10(17)5-7-11/h4-7H,8-9H2,1-3H3
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Article
PubMed
n/an/a 1.83E+3n/an/an/an/an/an/a



North-West University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOA expressed in baculovirus infected insect cell microsomes using kynuramine as substrate assessed as formation of ...


Eur J Med Chem 46: 3474-85 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.014
BindingDB Entry DOI: 10.7270/Q2JH3MJH
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50348843
PNG
(CHEMBL1806767)
Show SMILES Cn1c(OCCOc2ccc(Cl)cc2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C16H17ClN4O4/c1-19-12-13(20(2)16(23)21(3)14(12)22)18-15(19)25-9-8-24-11-6-4-10(17)5-7-11/h4-7H,8-9H2,1-3H3
PDB

Reactome pathway

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antibodypedia
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PC sid
UniChem

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Article
PubMed
n/an/a 183n/an/an/an/an/an/a



North-West University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MAOB expressed in baculovirus infected insect cell microsomes using kynuramine as substrate assessed as formation of ...


Eur J Med Chem 46: 3474-85 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.014
BindingDB Entry DOI: 10.7270/Q2JH3MJH
More data for this
Ligand-Target Pair