Found 2 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 1' and Ligand = 'BDBM50020079' 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)) | BDBM50020079
(CHEMBL3287859)Show SMILES OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2OCCN(C(=O)Nc3ccccc3)c2c1 |r,wU:7.10,wD:4.3,(28.28,-.1,;26.95,-.87,;26.95,-2.41,;25.61,-.1,;24.28,-.87,;22.95,-.1,;21.61,-.87,;21.61,-2.41,;22.95,-3.18,;24.28,-2.41,;20.28,-3.18,;20.28,-4.72,;18.94,-5.49,;17.61,-4.72,;17.61,-3.18,;18.94,-2.41,;16.28,-5.49,;16.28,-7.03,;14.94,-7.8,;13.61,-7.03,;12.28,-7.8,;10.94,-7.03,;10.94,-5.49,;12.28,-4.72,;12.28,-3.18,;13.61,-2.41,;10.94,-2.41,;10.94,-.87,;9.61,-.1,;9.61,1.44,;10.94,2.21,;12.28,1.44,;12.28,-.1,;13.61,-5.49,;14.94,-4.72,)| Show InChI InChI=1S/C29H30N2O4/c32-28(33)18-20-6-8-21(9-7-20)22-10-12-23(13-11-22)24-14-15-27-26(19-24)31(16-17-35-27)29(34)30-25-4-2-1-3-5-25/h1-5,10-15,19-21H,6-9,16-18H2,(H,30,34)(H,32,33)/t20-,21- | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of mouse DGAT1 expressed in Sf9 insect cells using 1,2-dioleoyl-sn-glycerol and [14C]-palmitoyl-CoA substrate by scintillation counting an... |
ACS Med Chem Lett 5: 544-9 (2014)
Article DOI: 10.1021/ml400527n BindingDB Entry DOI: 10.7270/Q2KS6T3C |
More data for this Ligand-Target Pair | |
Diacylglycerol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50020079
(CHEMBL3287859)Show SMILES OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2OCCN(C(=O)Nc3ccccc3)c2c1 |r,wU:7.10,wD:4.3,(28.28,-.1,;26.95,-.87,;26.95,-2.41,;25.61,-.1,;24.28,-.87,;22.95,-.1,;21.61,-.87,;21.61,-2.41,;22.95,-3.18,;24.28,-2.41,;20.28,-3.18,;20.28,-4.72,;18.94,-5.49,;17.61,-4.72,;17.61,-3.18,;18.94,-2.41,;16.28,-5.49,;16.28,-7.03,;14.94,-7.8,;13.61,-7.03,;12.28,-7.8,;10.94,-7.03,;10.94,-5.49,;12.28,-4.72,;12.28,-3.18,;13.61,-2.41,;10.94,-2.41,;10.94,-.87,;9.61,-.1,;9.61,1.44,;10.94,2.21,;12.28,1.44,;12.28,-.1,;13.61,-5.49,;14.94,-4.72,)| Show InChI InChI=1S/C29H30N2O4/c32-28(33)18-20-6-8-21(9-7-20)22-10-12-23(13-11-22)24-14-15-27-26(19-24)31(16-17-35-27)29(34)30-25-4-2-1-3-5-25/h1-5,10-15,19-21H,6-9,16-18H2,(H,30,34)(H,32,33)/t20-,21- | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description Inhibition of human DGAT1 expressed in Sf9 insect cells using 1,2-dioleoyl-sn-glycerol and [14C]-palmitoyl-CoA substrate by scintillation counting an... |
ACS Med Chem Lett 5: 544-9 (2014)
Article DOI: 10.1021/ml400527n BindingDB Entry DOI: 10.7270/Q2KS6T3C |
More data for this Ligand-Target Pair | |