Found 2 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 1' and Ligand = 'BDBM50020052' 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)) | BDBM50020052
(CHEMBL3287882)Show SMILES OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)NCCCCc1ccccc1 |r,wU:7.10,wD:4.3,(22.51,3.03,;21.2,2.23,;19.85,2.96,;21.24,.69,;19.92,-.12,;18.57,.63,;17.25,-.18,;17.29,-1.72,;18.64,-2.46,;19.96,-1.66,;15.98,-2.52,;14.63,-1.78,;13.31,-2.58,;13.35,-4.12,;14.7,-4.86,;16.01,-4.06,;12.03,-4.92,;12.07,-6.46,;10.76,-7.26,;9.4,-6.52,;8.09,-7.32,;6.74,-6.58,;6.7,-5.04,;8.02,-4.24,;9.37,-4.98,;10.68,-4.18,;8.13,-8.86,;9.47,-9.6,;6.81,-9.66,;6.84,-11.2,;5.53,-12,;5.58,-13.53,;4.27,-14.34,;4.31,-15.87,;3,-16.68,;3.05,-18.22,;4.4,-18.95,;5.72,-18.13,;5.67,-16.6,)| Show InChI InChI=1S/C33H38N2O4/c36-32(37)22-25-9-11-26(12-10-25)27-13-15-28(16-14-27)29-17-18-30-31(23-29)39-21-20-35(30)33(38)34-19-5-4-8-24-6-2-1-3-7-24/h1-3,6-7,13-18,23,25-26H,4-5,8-12,19-22H2,(H,34,38)(H,36,37)/t25-,26- | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 36 | 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)) | BDBM50020052
(CHEMBL3287882)Show SMILES OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)NCCCCc1ccccc1 |r,wU:7.10,wD:4.3,(22.51,3.03,;21.2,2.23,;19.85,2.96,;21.24,.69,;19.92,-.12,;18.57,.63,;17.25,-.18,;17.29,-1.72,;18.64,-2.46,;19.96,-1.66,;15.98,-2.52,;14.63,-1.78,;13.31,-2.58,;13.35,-4.12,;14.7,-4.86,;16.01,-4.06,;12.03,-4.92,;12.07,-6.46,;10.76,-7.26,;9.4,-6.52,;8.09,-7.32,;6.74,-6.58,;6.7,-5.04,;8.02,-4.24,;9.37,-4.98,;10.68,-4.18,;8.13,-8.86,;9.47,-9.6,;6.81,-9.66,;6.84,-11.2,;5.53,-12,;5.58,-13.53,;4.27,-14.34,;4.31,-15.87,;3,-16.68,;3.05,-18.22,;4.4,-18.95,;5.72,-18.13,;5.67,-16.6,)| Show InChI InChI=1S/C33H38N2O4/c36-32(37)22-25-9-11-26(12-10-25)27-13-15-28(16-14-27)29-17-18-30-31(23-29)39-21-20-35(30)33(38)34-19-5-4-8-24-6-2-1-3-7-24/h1-3,6-7,13-18,23,25-26H,4-5,8-12,19-22H2,(H,34,38)(H,36,37)/t25-,26- | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 91 | 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 | |