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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 2' and Ligand = 'BDBM323602'   
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
Diacylglycerol O-acyltransferase 2


(Homo sapiens (Human))
BDBM323602
PNG
(US10188653, Example 8 | US9789110, 8)
Show SMILES CCOc1ccccc1O[C@@H]1CCCN(C1)c1ncc(cc1F)C(=O)NCc1ccnc(c1)C(O)=O |r|
Show InChI InChI=1S/C26H27FN4O5/c1-2-35-22-7-3-4-8-23(22)36-19-6-5-11-31(16-19)24-20(27)13-18(15-29-24)25(32)30-14-17-9-10-28-21(12-17)26(33)34/h3-4,7-10,12-13,15,19H,2,5-6,11,14,16H2,1H3,(H,30,32)(H,33,34)/t19-/m1/s1
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UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 9.70n/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
For determination of IC50 values, the reactions were carried out in 384-well white Polyplates (Perkin Elmer) in a total volume of 20 μL. To 14 o...


US Patent US9789110 (2017)


BindingDB Entry DOI: 10.7270/Q20G3N81
More data for this
Ligand-Target Pair
Diacylglycerol O-acyltransferase 2


(Homo sapiens (Human))
BDBM323602
PNG
(US10188653, Example 8 | US9789110, 8)
Show SMILES CCOc1ccccc1O[C@@H]1CCCN(C1)c1ncc(cc1F)C(=O)NCc1ccnc(c1)C(O)=O |r|
Show InChI InChI=1S/C26H27FN4O5/c1-2-35-22-7-3-4-8-23(22)36-19-6-5-11-31(16-19)24-20(27)13-18(15-29-24)25(32)30-14-17-9-10-28-21(12-17)26(33)34/h3-4,7-10,12-13,15,19H,2,5-6,11,14,16H2,1H3,(H,30,32)(H,33,34)/t19-/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 9.70n/an/an/an/an/an/a



Pfizer Inc.

US Patent


Assay Description
For determination of IC50 values, the reactions were carried out in 384-well white Polyplates (Perkin Elmer) in a total volume of 20 μL. To 14 o...


US Patent US10188653 (2019)


BindingDB Entry DOI: 10.7270/Q28G8NS4
More data for this
Ligand-Target Pair