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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 476.4
BDBM360587

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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))
BDBM360587
PNG
((cis)-N-((5-(3-methoxyphenyl) isoquinolin-8-yl)met...)
Show SMILES COc1cccc(c1)-c1ccc(CNC(=O)[C@@H]2C[C@@H]2c2ccc(cc2)C(F)(F)F)c2cnccc12 |r|
Show InChI InChI=1S/C28H23F3N2O2/c1-35-21-4-2-3-18(13-21)22-10-7-19(26-16-32-12-11-23(22)26)15-33-27(34)25-14-24(25)17-5-8-20(9-6-17)28(29,30)31/h2-13,16,24-25H,14-15H2,1H3,(H,33,34)/t24-,25-/m1/s1
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KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.56E+3n/an/an/an/an/an/a



Merck Sharpe & Dohme Corp.

US Patent


Assay Description
DGAT2 activity was determined by measuring the amount of enzymatic product triolein (1,2,3-Tri(cis-9-octadecenoyl)glycerol) using the membrane prep m...


US Patent US9828369 (2017)


BindingDB Entry DOI: 10.7270/Q2DN47C7
More data for this
Ligand-Target Pair