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BDBM50446742 CHEMBL3114412

InChI string: InChI=1S/C13H21NO4/c14-10-11-12(17-8-2-6-15)4-1-5-13(11)18-9-3-7-16/h1,4-5,15-16H,2-3,6-10,14H2

SMILES: NCc1c(OCCCO)cccc1OCCCO

InChI Key: InChIKey=JYDFIIDBEZMFFO-UHFFFAOYSA-N

Data: 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 2 hits for monomerid = 50446742   
Target
(Institution)
LigandTarget
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
Amiloride-sensitive amine oxidase [copper-containing]


(Sus scrofa)
BDBM50446742
PNG
(CHEMBL3114412)
Show SMILES NCc1c(OCCCO)cccc1OCCCO
Show InChI InChI=1S/C13H21NO4/c14-10-11-12(17-8-2-6-15)4-1-5-13(11)18-9-3-7-16/h1,4-5,15-16H,2-3,6-10,14H2
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of porcine kidney DAO using [1,4-14C]-putrescine as substrate preincubated for 30 mins followed by substrate addition


Citation and Details
More data for this
Ligand-Target Pair
Protein-lysine 6-oxidase


(Sus scrofa)
BDBM50446742
PNG
(CHEMBL3114412)
Show SMILES NCc1c(OCCCO)cccc1OCCCO
Show InChI InChI=1S/C13H21NO4/c14-10-11-12(17-8-2-6-15)4-1-5-13(11)18-9-3-7-16/h1,4-5,15-16H,2-3,6-10,14H2
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



Universit£ di Genova

Curated by ChEMBL


Assay Description
Inhibition of porcine aorta lysyl oxidase preincubated for 30 mins followed by substrate addition


Citation and Details
More data for this
Ligand-Target Pair