Found 2 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 1' and Ligand = 'BDBM209530' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Diacylglycerol O-acyltransferase 1
(Mus musculus (mouse)) | BDBM209530
(US9271969, 18)Show SMILES COc1ccc(OC(F)(F)F)cc1CNC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 |r,wD:35.39,(-5.83,5.49,;-6.6,4.16,;-8.14,4.16,;-8.91,5.49,;-10.45,5.49,;-11.22,4.16,;-12.76,4.16,;-13.84,3.07,;-14.93,1.98,;-12.76,1.98,;-14.61,4.41,;-10.45,2.83,;-8.91,2.83,;-8.14,1.49,;-6.6,1.49,;-5.83,.16,;-6.6,-1.17,;-4.29,.16,;-3.38,-1.09,;-1.92,-.61,;-.58,-1.38,;.75,-.61,;.75,.93,;-.58,1.7,;-1.92,.93,;-3.38,1.41,;2.09,-1.38,;2.09,-2.92,;3.42,-3.69,;4.75,-2.92,;4.75,-1.38,;3.42,-.61,;6.09,-3.69,;7.42,-2.92,;8.75,-3.69,;8.75,-5.23,;10.09,-6,;11.42,-5.23,;12.76,-6,;11.42,-3.69,;7.42,-6,;6.09,-5.23,)| Show InChI InChI=1S/C31H30F3N3O5/c1-41-27-12-11-25(42-31(32,33)34)15-24(27)16-35-30(40)26-18-37-17-23(10-13-28(37)36-26)22-8-6-21(7-9-22)20-4-2-19(3-5-20)14-29(38)39/h6-13,15,17-20H,2-5,14,16H2,1H3,(H,35,40)(H,38,39)/t19-,20? | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | <1 | n/a | n/a | n/a | n/a | 7.4 | 25 |
KAINOS MEDICINE, INC.
US Patent
| Assay Description
Assay buffer [20 mM HEPES (pH 7.4), 100 mM MgCl2 and 0.04% bovine serum albumin (BSA)] containing 500 uM of enzyme substrate (didecanoyl glycerol) ... |
US Patent US9271969 (2016)
BindingDB Entry DOI: 10.7270/Q2057DS8 |
More data for this
Ligand-Target Pair | |
Diacylglycerol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM209530
(US9271969, 18)Show SMILES COc1ccc(OC(F)(F)F)cc1CNC(=O)c1cn2cc(ccc2n1)-c1ccc(cc1)C1CC[C@H](CC(O)=O)CC1 |r,wD:35.39,(-5.83,5.49,;-6.6,4.16,;-8.14,4.16,;-8.91,5.49,;-10.45,5.49,;-11.22,4.16,;-12.76,4.16,;-13.84,3.07,;-14.93,1.98,;-12.76,1.98,;-14.61,4.41,;-10.45,2.83,;-8.91,2.83,;-8.14,1.49,;-6.6,1.49,;-5.83,.16,;-6.6,-1.17,;-4.29,.16,;-3.38,-1.09,;-1.92,-.61,;-.58,-1.38,;.75,-.61,;.75,.93,;-.58,1.7,;-1.92,.93,;-3.38,1.41,;2.09,-1.38,;2.09,-2.92,;3.42,-3.69,;4.75,-2.92,;4.75,-1.38,;3.42,-.61,;6.09,-3.69,;7.42,-2.92,;8.75,-3.69,;8.75,-5.23,;10.09,-6,;11.42,-5.23,;12.76,-6,;11.42,-3.69,;7.42,-6,;6.09,-5.23,)| Show InChI InChI=1S/C31H30F3N3O5/c1-41-27-12-11-25(42-31(32,33)34)15-24(27)16-35-30(40)26-18-37-17-23(10-13-28(37)36-26)22-8-6-21(7-9-22)20-4-2-19(3-5-20)14-29(38)39/h6-13,15,17-20H,2-5,14,16H2,1H3,(H,35,40)(H,38,39)/t19-,20? | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | <10 | n/a | n/a | n/a | n/a | 7.4 | 25 |
KAINOS MEDICINE, INC.
US Patent
| Assay Description
Assay buffer [20 mM HEPES (pH 7.4), 100 mM MgCl2 and 0.04% bovine serum albumin (BSA)] containing 500 uM of enzyme substrate (didecanoyl glycerol) ... |
US Patent US9271969 (2016)
BindingDB Entry DOI: 10.7270/Q2057DS8 |
More data for this
Ligand-Target Pair | |
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