Found 2 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 1' and Ligand = 'BDBM50438732' 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
(Homo sapiens (Human)) | BDBM50438732
(CHEMBL2414656)Show SMILES COC1CCN(CC1)C(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O |r,wU:14.18,wD:11.11,(50.69,-40.93,;49.17,-40.68,;48.17,-41.89,;46.66,-41.63,;45.68,-42.82,;46.22,-44.29,;47.73,-44.51,;48.71,-43.33,;45.22,-45.51,;45.76,-46.95,;43.71,-45.25,;42.71,-46.47,;41.19,-46.22,;40.21,-47.4,;40.76,-48.87,;42.26,-49.09,;43.23,-47.91,;39.75,-50.09,;38.24,-49.84,;37.25,-51.03,;37.8,-52.48,;39.31,-52.71,;40.29,-51.53,;36.8,-53.69,;37.47,-55.1,;36.78,-56.5,;35.26,-56.83,;34.06,-55.83,;32.7,-56.61,;31.36,-55.82,;31.37,-54.26,;32.73,-53.49,;32.75,-51.94,;34.07,-54.29,;35.3,-53.33,;34.97,-51.8,)| Show InChI InChI=1S/C27H35N5O4/c1-35-22-10-12-31(13-11-22)23(33)16-18-2-4-19(5-3-18)20-6-8-21(9-7-20)32-14-15-36-26-24(27(32)34)25(28)29-17-30-26/h6-9,17-19,22H,2-5,10-16H2,1H3,(H2,28,29,30)/t18-,19- | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human full length DGAT-1 expressed in insect sf9 cells using [14C]decanoylCoA as substrate after 1.5 hrs by scintillation spectrometry |
Bioorg Med Chem 21: 5081-97 (2013)
Article DOI: 10.1016/j.bmc.2013.06.045 BindingDB Entry DOI: 10.7270/Q26111RG |
More data for this Ligand-Target Pair | |
Diacylglycerol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50438732
(CHEMBL2414656)Show SMILES COC1CCN(CC1)C(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)N1CCOc2ncnc(N)c2C1=O |r,wU:14.18,wD:11.11,(50.69,-40.93,;49.17,-40.68,;48.17,-41.89,;46.66,-41.63,;45.68,-42.82,;46.22,-44.29,;47.73,-44.51,;48.71,-43.33,;45.22,-45.51,;45.76,-46.95,;43.71,-45.25,;42.71,-46.47,;41.19,-46.22,;40.21,-47.4,;40.76,-48.87,;42.26,-49.09,;43.23,-47.91,;39.75,-50.09,;38.24,-49.84,;37.25,-51.03,;37.8,-52.48,;39.31,-52.71,;40.29,-51.53,;36.8,-53.69,;37.47,-55.1,;36.78,-56.5,;35.26,-56.83,;34.06,-55.83,;32.7,-56.61,;31.36,-55.82,;31.37,-54.26,;32.73,-53.49,;32.75,-51.94,;34.07,-54.29,;35.3,-53.33,;34.97,-51.8,)| Show InChI InChI=1S/C27H35N5O4/c1-35-22-10-12-31(13-11-22)23(33)16-18-2-4-19(5-3-18)20-6-8-21(9-7-20)32-14-15-36-26-24(27(32)34)25(28)29-17-30-26/h6-9,17-19,22H,2-5,10-16H2,1H3,(H2,28,29,30)/t18-,19- | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 66 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of DGAT-1-mediated triglyceride synthesis in human HT-29 cells using [3H]-glycerol as substrate incubated for 1 hr prior to substrate addi... |
Bioorg Med Chem 21: 5081-97 (2013)
Article DOI: 10.1016/j.bmc.2013.06.045 BindingDB Entry DOI: 10.7270/Q26111RG |
More data for this Ligand-Target Pair | |