Found 2 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 1' and Ligand = 'BDBM50020083' 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)) | BDBM50020083
(CHEMBL3287872)Show SMILES OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)c1nc2ccccc2o1 |r,wU:4.3,wD:7.10,(3.07,-6.86,;4.61,-6.86,;5.38,-5.53,;5.38,-8.2,;6.92,-8.2,;7.69,-6.86,;9.23,-6.86,;10,-8.2,;9.23,-9.53,;7.69,-9.53,;11.54,-8.2,;12.31,-6.86,;13.85,-6.86,;14.62,-8.2,;13.85,-9.53,;12.31,-9.53,;16.16,-8.2,;16.93,-9.53,;18.47,-9.53,;19.24,-8.2,;20.78,-8.2,;21.55,-6.86,;20.78,-5.53,;19.24,-5.53,;18.47,-6.86,;16.93,-6.86,;21.55,-9.53,;20.92,-10.94,;22.07,-11.97,;22.07,-13.51,;23.4,-14.28,;24.73,-13.51,;24.73,-11.97,;23.4,-11.2,;23.08,-9.69,)| Show InChI InChI=1S/C29H28N2O4/c32-28(33)17-19-5-7-20(8-6-19)21-9-11-22(12-10-21)23-13-14-25-27(18-23)34-16-15-31(25)29-30-24-3-1-2-4-26(24)35-29/h1-4,9-14,18-20H,5-8,15-17H2,(H,32,33)/t19-,20- | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
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)) | BDBM50020083
(CHEMBL3287872)Show SMILES OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)c1nc2ccccc2o1 |r,wU:4.3,wD:7.10,(3.07,-6.86,;4.61,-6.86,;5.38,-5.53,;5.38,-8.2,;6.92,-8.2,;7.69,-6.86,;9.23,-6.86,;10,-8.2,;9.23,-9.53,;7.69,-9.53,;11.54,-8.2,;12.31,-6.86,;13.85,-6.86,;14.62,-8.2,;13.85,-9.53,;12.31,-9.53,;16.16,-8.2,;16.93,-9.53,;18.47,-9.53,;19.24,-8.2,;20.78,-8.2,;21.55,-6.86,;20.78,-5.53,;19.24,-5.53,;18.47,-6.86,;16.93,-6.86,;21.55,-9.53,;20.92,-10.94,;22.07,-11.97,;22.07,-13.51,;23.4,-14.28,;24.73,-13.51,;24.73,-11.97,;23.4,-11.2,;23.08,-9.69,)| Show InChI InChI=1S/C29H28N2O4/c32-28(33)17-19-5-7-20(8-6-19)21-9-11-22(12-10-21)23-13-14-25-27(18-23)34-16-15-31(25)29-30-24-3-1-2-4-26(24)35-29/h1-4,9-14,18-20H,5-8,15-17H2,(H,32,33)/t19-,20- | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
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 | |