Ki Summary

Reaction Details

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Target

Diacylglycerol O-acyltransferase 1

Ligand

BDBM50438717

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_976373 (CHEMBL2415509)

IC50

79±n/a nM

Citation

Dow, RL; Andrews, MP; Li, JC; Michael Gibbs, E; Guzman-Perez, A; Laperle, JL; Li, Q; Mather, D; Munchhof, MJ; Niosi, M; Patel, L; Perreault, C; Tapley, S; Zavadoski, WJ Defining the key pharmacophore elements of PF-04620110: discovery of a potent, orally-active, neutral DGAT-1 inhibitor. Bioorg Med Chem21:5081-97 (2013) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Diacylglycerol O-acyltransferase 1

Name:

Diacylglycerol O-acyltransferase 1

Synonyms:

Type:

Protein

Mol. Mass.:

55297.82

Organism:

Homo sapiens (Human)

Description:

O75907

Residue:

488

Sequence:

MGDRGSSRRRRTGSRPSSHGGGGPAAAEEEVRDAAAGPDVGAAGDAPAPAPNKDGDAGVG
SGHWELRCHRLQDSLFSSDSGFSNYRGILNWCVVMLILSNARLFLENLIKYGILVDPIQV
VSLFLKDPYSWPAPCLVIAANVFAVAAFQVEKRLAVGALTEQAGLLLHVANLATILCFPA
AVVLLVESITPVGSLLALMAHTILFLKLFSYRDVNSWCRRARAKAASAGKKASSAAAPHT
VSYPDNLTYRDLYYFLFAPTLCYELNFPRSPRIRKRFLLRRILEMLFFTQLQVGLIQQWM
VPTIQNSMKPFKDMDYSRIIERLLKLAVPNHLIWLIFFYWLFHSCLNAVAELMQFGDREF
YRDWWNSESVTYFWQNWNIPVHKWCIRHFYKPMLRRGSSKWMARTGVFLASAFFHEYLVS
VPLRMFRLWAFTGMMAQIPLAWFVGRFFQGNYGNAAVWLSLIIGQPIAVLMYVHDYYVLN
YEAPAAEA

BDBM50438717

n/a

Name

BDBM50438717

Synonyms:

CHEMBL2414657

Type

Small organic molecule

Emp. Form.

C24H29N5O4

Mol. Mass.

451.5182

SMILES

Nc1ncnc2OCCN(c3ccc(cc3)[C@H]3CC[C@H](CC(=O)N4CC(O)C4)CC3)C(=O)c12 |r,wU:16.16,wD:19.20,(24.81,-51.13,;24.79,-52.69,;23.43,-53.45,;23.41,-55.01,;24.75,-55.8,;26.11,-55.03,;27.3,-56.03,;28.82,-55.7,;29.52,-54.31,;28.86,-52.9,;29.86,-51.7,;29.31,-50.24,;30.3,-49.05,;31.81,-49.32,;32.35,-50.76,;31.37,-51.93,;32.82,-48.1,;32.28,-46.63,;33.26,-45.45,;34.77,-45.71,;35.78,-44.5,;37.29,-44.76,;37.82,-46.2,;38.3,-43.55,;38.16,-41.99,;39.67,-41.85,;40.67,-40.64,;39.81,-43.38,;35.3,-47.15,;34.32,-48.33,;27.36,-52.53,;27.03,-51.01,;26.12,-53.48,)|

Structure