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SMILES: CN(CCCOc1ccc(Cl)cc1Cl)CC=C=C

InChI Key: InChIKey=ONILPGUBZDCZPG-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50224952   
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/B


(Rattus norvegicus (rat))		BDBM50224952
PNG
(CHEMBL441014)
Show SMILES CN(CCCOc1ccc(Cl)cc1Cl)CC=C=C
Show InChI InChI=1S/C14H17Cl2NO/c1-3-4-8-17(2)9-5-10-18-14-7-6-12(15)11-13(14)16/h4,6-7,11H,1,5,8-10H2,2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Monoamine oxidase at rat hyphalamic mitochondrial 5-HT by displacing 2.5 uM of [14C]5-HT.

J Med Chem 26: 1036-42 (1983)


BindingDB Entry DOI: 10.7270/Q2K076FV
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A/B


(Rattus norvegicus (rat))		BDBM50224952
PNG
(CHEMBL441014)
Show SMILES CN(CCCOc1ccc(Cl)cc1Cl)CC=C=C
Show InChI InChI=1S/C14H17Cl2NO/c1-3-4-8-17(2)9-5-10-18-14-7-6-12(15)11-13(14)16/h4,6-7,11H,1,5,8-10H2,2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 4.60E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Monoamine oxidase at rat hyphalamic mitochondrial PEA by displacing 2.5 uM of [14C]PEA.

J Med Chem 26: 1036-42 (1983)


BindingDB Entry DOI: 10.7270/Q2K076FV
More data for this
Ligand-Target Pair