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BDBM50363411 CHEMBL596254

SMILES: Clc1ccc(\C=C2/Oc3ccccc3C2=O)cc1

InChI Key: InChIKey=JIWJNEVCSMZRGO-ZROIWOOFSA-N

Data: 3 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50363411   
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) A


(Homo sapiens (Human))
BDBM50363411
PNG
(CHEMBL596254)
Show SMILES Clc1ccc(\C=C2/Oc3ccccc3C2=O)cc1
Show InChI InChI=1S/C15H9ClO2/c16-11-7-5-10(6-8-11)9-14-15(17)12-3-1-2-4-13(12)18-14/h1-9H/b14-9-
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 709n/an/an/an/an/an/a



Northeast Ohio Medical University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOA using kynuramine as substrate by fluorimetry


Bioorg Med Chem Lett 22: 1380-3 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.056
BindingDB Entry DOI: 10.7270/Q2J67HDW
More data for this
Ligand-Target Pair
Neuraminidase


(Influenza A virus (A/Puerto Rico/8/34/Mount Sinai(...)
BDBM50363411
PNG
(CHEMBL596254)
Show SMILES Clc1ccc(\C=C2/Oc3ccccc3C2=O)cc1
Show InChI InChI=1S/C15H9ClO2/c16-11-7-5-10(6-8-11)9-14-15(17)12-3-1-2-4-13(12)18-14/h1-9H/b14-9-
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

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PubMed
n/an/a 4.54E+4n/an/an/an/an/an/a



Prin. K.M. Kundnani College of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of Influenza A virus (H1N1) neuraminidase


Bioorg Med Chem 28: (2020)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50363411
PNG
(CHEMBL596254)
Show SMILES Clc1ccc(\C=C2/Oc3ccccc3C2=O)cc1
Show InChI InChI=1S/C15H9ClO2/c16-11-7-5-10(6-8-11)9-14-15(17)12-3-1-2-4-13(12)18-14/h1-9H/b14-9-
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 305n/an/an/an/an/an/a



Northeast Ohio Medical University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB using kynuramine as substrate by fluorimetry


Bioorg Med Chem Lett 22: 1380-3 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.056
BindingDB Entry DOI: 10.7270/Q2J67HDW
More data for this
Ligand-Target Pair