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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Membrane primary amine oxidase' and Ligand = 'BDBM220876'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Membrane primary amine oxidase


(Rattus norvegicus (Rat))
BDBM220876
PNG
(US9302986, 15)
Show SMILES CN(C)S(=O)(=O)c1cccc(OC\C(CN)=C/F)c1
Show InChI InChI=1S/C12H17FN2O3S/c1-15(2)19(16,17)12-5-3-4-11(6-12)18-9-10(7-13)8-14/h3-7H,8-9,14H2,1-2H3/b10-7-
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+5n/an/an/an/a7.4n/a



BOEHRINGER INGELHEIM INTERNATIONAL GMBH

US Patent


Assay Description
Abdominal fat from BALB/c mice, Wistar or Sprague Dawley rats, which are tissues enriched with SSAO/VAP-1-were surgically removed. For every gram of ...


US Patent US9302986 (2016)


BindingDB Entry DOI: 10.7270/Q2ZC81QZ
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM220876
PNG
(US9302986, 15)
Show SMILES CN(C)S(=O)(=O)c1cccc(OC\C(CN)=C/F)c1
Show InChI InChI=1S/C12H17FN2O3S/c1-15(2)19(16,17)12-5-3-4-11(6-12)18-9-10(7-13)8-14/h3-7H,8-9,14H2,1-2H3/b10-7-
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+5n/an/an/an/a7.4n/a



BOEHRINGER INGELHEIM INTERNATIONAL GMBH

US Patent


Assay Description
Briefly, HMEC cell expressing human SSAO/VAP-1 were grown in several 10 cm petri dishes, once the cells reached 100% confluency, cells were harvested...


US Patent US9302986 (2016)


BindingDB Entry DOI: 10.7270/Q2ZC81QZ
More data for this
Ligand-Target Pair