Found 2 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 1' and Ligand = 'BDBM209564' 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)) | BDBM209564
(US9271969, 52)Show SMILES OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)Nc1cccc(OC(F)(F)F)c1 |r,wU:7.10,wD:4.3,(12.35,2,;10.88,2,;10.11,3.33,;10.11,.67,;8.57,.67,;7.8,2,;6.26,2,;5.49,.67,;6.26,-.67,;7.8,-.67,;3.95,.67,;3.18,-.67,;1.64,-.67,;.87,.67,;1.64,2,;3.18,2,;-.67,.67,;-1.58,-.58,;-3.05,-.1,;-4.51,-.58,;-5.41,.67,;-4.51,1.91,;-3.05,1.44,;-1.58,1.91,;-6.96,.67,;-7.73,2,;-7.73,-.67,;-9.27,-.67,;-10.04,.67,;-11.58,.67,;-12.35,-.67,;-11.58,-2,;-12.35,-3.33,;-13.89,-3.33,;-15.43,-3.33,;-13.89,-4.87,;-13.49,-1.85,;-10.04,-2,)| Show InChI InChI=1S/C27H24F3N3O4S/c28-27(29,30)37-21-3-1-2-20(13-21)31-25(36)22-14-33-15-23(38-26(33)32-22)19-10-8-18(9-11-19)17-6-4-16(5-7-17)12-24(34)35/h1-3,8-11,13-17H,4-7,12H2,(H,31,36)(H,34,35)/t16-,17- | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
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 | |
Diacylglycerol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM209564
(US9271969, 52)Show SMILES OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1cn2cc(nc2s1)C(=O)Nc1cccc(OC(F)(F)F)c1 |r,wU:7.10,wD:4.3,(12.35,2,;10.88,2,;10.11,3.33,;10.11,.67,;8.57,.67,;7.8,2,;6.26,2,;5.49,.67,;6.26,-.67,;7.8,-.67,;3.95,.67,;3.18,-.67,;1.64,-.67,;.87,.67,;1.64,2,;3.18,2,;-.67,.67,;-1.58,-.58,;-3.05,-.1,;-4.51,-.58,;-5.41,.67,;-4.51,1.91,;-3.05,1.44,;-1.58,1.91,;-6.96,.67,;-7.73,2,;-7.73,-.67,;-9.27,-.67,;-10.04,.67,;-11.58,.67,;-12.35,-.67,;-11.58,-2,;-12.35,-3.33,;-13.89,-3.33,;-15.43,-3.33,;-13.89,-4.87,;-13.49,-1.85,;-10.04,-2,)| Show InChI InChI=1S/C27H24F3N3O4S/c28-27(29,30)37-21-3-1-2-20(13-21)31-25(36)22-14-33-15-23(38-26(33)32-22)19-10-8-18(9-11-19)17-6-4-16(5-7-17)12-24(34)35/h1-3,8-11,13-17H,4-7,12H2,(H,31,36)(H,34,35)/t16-,17- | 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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