Found 2 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 1' and Ligand = 'BDBM209554' 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)) | BDBM209554
![PNG](/data/jpeg/tenK20/BindingDB_209554.png) (US9271969, 42)Show SMILES OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1c(F)cc(Cl)cc1F |r,wD:4.3,(11.99,-6.41,;10.65,-5.64,;10.65,-4.1,;9.32,-6.41,;7.98,-5.64,;7.98,-4.1,;6.65,-3.33,;5.32,-4.1,;5.32,-5.64,;6.65,-6.41,;3.98,-3.33,;2.65,-4.1,;1.32,-3.33,;1.32,-1.79,;2.65,-1.02,;3.98,-1.79,;-.02,-1.02,;-.02,.52,;-1.35,1.29,;-2.69,.52,;-4.15,.99,;-5.06,-.25,;-4.15,-1.5,;-2.69,-1.02,;-1.35,-1.79,;-6.6,-.25,;-7.37,-1.59,;-7.37,1.08,;-8.91,1.08,;-9.68,2.41,;-11.22,2.41,;-11.99,1.08,;-11.99,3.75,;-11.22,5.08,;-11.99,6.41,;-9.68,5.08,;-8.91,3.75,;-7.37,3.75,)| Show InChI InChI=1S/C29H26ClF2N3O3/c30-22-12-24(31)23(25(32)13-22)14-33-29(38)26-16-35-15-21(9-10-27(35)34-26)20-7-5-19(6-8-20)18-3-1-17(2-4-18)11-28(36)37/h5-10,12-13,15-18H,1-4,11,14H2,(H,33,38)(H,36,37)/t17-,18? | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| 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)) | BDBM209554
![PNG](/data/jpeg/tenK20/BindingDB_209554.png) (US9271969, 42)Show SMILES OC(=O)C[C@H]1CCC(CC1)c1ccc(cc1)-c1ccc2nc(cn2c1)C(=O)NCc1c(F)cc(Cl)cc1F |r,wD:4.3,(11.99,-6.41,;10.65,-5.64,;10.65,-4.1,;9.32,-6.41,;7.98,-5.64,;7.98,-4.1,;6.65,-3.33,;5.32,-4.1,;5.32,-5.64,;6.65,-6.41,;3.98,-3.33,;2.65,-4.1,;1.32,-3.33,;1.32,-1.79,;2.65,-1.02,;3.98,-1.79,;-.02,-1.02,;-.02,.52,;-1.35,1.29,;-2.69,.52,;-4.15,.99,;-5.06,-.25,;-4.15,-1.5,;-2.69,-1.02,;-1.35,-1.79,;-6.6,-.25,;-7.37,-1.59,;-7.37,1.08,;-8.91,1.08,;-9.68,2.41,;-11.22,2.41,;-11.99,1.08,;-11.99,3.75,;-11.22,5.08,;-11.99,6.41,;-9.68,5.08,;-8.91,3.75,;-7.37,3.75,)| Show InChI InChI=1S/C29H26ClF2N3O3/c30-22-12-24(31)23(25(32)13-22)14-33-29(38)26-16-35-15-21(9-10-27(35)34-26)20-7-5-19(6-8-20)18-3-1-17(2-4-18)11-28(36)37/h5-10,12-13,15-18H,1-4,11,14H2,(H,33,38)(H,36,37)/t17-,18? | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| 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 | |