Found 2 hits Enz. Inhib. hit(s) with Target = 'Diacylglycerol O-acyltransferase 1' and Ligand = 'BDBM50438736' 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)) | BDBM50438736
(CHEMBL2414678)Show SMILES Cc1nc(N)c2c(OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C2=O)n1 |r,wU:17.17,wD:20.21,(19.91,-46.4,;21.27,-45.67,;21.32,-44.12,;22.68,-43.39,;22.73,-41.85,;23.99,-44.21,;23.95,-45.74,;25.12,-46.75,;26.64,-46.45,;27.35,-45.08,;26.71,-43.66,;27.73,-42.47,;29.23,-42.76,;30.23,-41.6,;29.71,-40.12,;28.22,-39.87,;27.23,-41.03,;30.73,-38.94,;30.23,-37.5,;31.23,-36.34,;32.72,-36.6,;33.73,-35.42,;35.24,-35.71,;35.75,-37.16,;36.26,-34.54,;33.23,-38.06,;32.23,-39.22,;25.23,-43.28,;24.94,-41.76,;22.58,-46.48,)| Show InChI InChI=1S/C22H26N4O4/c1-13-24-20(23)19-21(25-13)30-11-10-26(22(19)29)17-8-6-16(7-9-17)15-4-2-14(3-5-15)12-18(27)28/h6-9,14-15H,2-5,10-12H2,1H3,(H,27,28)(H2,23,24,25)/t14-,15- | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 44 | 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 | |
Diacylglycerol O-acyltransferase 1
(Homo sapiens (Human)) | BDBM50438736
(CHEMBL2414678)Show SMILES Cc1nc(N)c2c(OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(O)=O)CC3)C2=O)n1 |r,wU:17.17,wD:20.21,(19.91,-46.4,;21.27,-45.67,;21.32,-44.12,;22.68,-43.39,;22.73,-41.85,;23.99,-44.21,;23.95,-45.74,;25.12,-46.75,;26.64,-46.45,;27.35,-45.08,;26.71,-43.66,;27.73,-42.47,;29.23,-42.76,;30.23,-41.6,;29.71,-40.12,;28.22,-39.87,;27.23,-41.03,;30.73,-38.94,;30.23,-37.5,;31.23,-36.34,;32.72,-36.6,;33.73,-35.42,;35.24,-35.71,;35.75,-37.16,;36.26,-34.54,;33.23,-38.06,;32.23,-39.22,;25.23,-43.28,;24.94,-41.76,;22.58,-46.48,)| Show InChI InChI=1S/C22H26N4O4/c1-13-24-20(23)19-21(25-13)30-11-10-26(22(19)29)17-8-6-16(7-9-17)15-4-2-14(3-5-15)12-18(27)28/h6-9,14-15H,2-5,10-12H2,1H3,(H,27,28)(H2,23,24,25)/t14-,15- | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 59 | 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 | |