Ki Summary

Reaction Details

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Target

Diacylglycerol O-acyltransferase 1

Ligand

BDBM50020073

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_1363771 (CHEMBL3294188)

IC50

1700±n/a nM

Citation

Zhou, G; Zorn, N; Ting, P; Aslanian, R; Lin, M; Cook, J; Lachowicz, J; Lin, A; Smith, M; Hwa, J; van Heek, M; Walker, S Development of novel benzomorpholine class of diacylglycerol acyltransferase I inhibitors. ACS Med Chem Lett5:544-9 (2014) [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

BDBM50020073

n/a

Name

BDBM50020073

Synonyms:

CHEMBL3287873

Type

Small organic molecule

Emp. Form.

C30H28F4N2O4

Mol. Mass.

556.5479

SMILES

OC(=O)C[C@H]1CC[C@@H](CC1)c1ccc(cc1)-c1ccc2N(CCOc2c1)C(=O)Nc1cc(ccc1F)C(F)(F)F |r,wU:4.3,wD:7.10,(1.78,-14.15,;3.12,-13.38,;3.12,-11.84,;4.45,-14.15,;5.78,-13.38,;5.78,-11.84,;7.12,-11.07,;8.45,-11.84,;8.45,-13.38,;7.12,-14.15,;9.79,-11.07,;9.79,-9.53,;11.12,-8.76,;12.45,-9.53,;12.45,-11.07,;11.12,-11.84,;13.79,-8.76,;15.12,-9.53,;16.45,-8.76,;16.45,-7.22,;17.79,-6.45,;17.79,-4.91,;16.45,-4.14,;15.12,-4.91,;15.12,-6.45,;13.79,-7.22,;19.12,-7.22,;19.12,-8.76,;20.46,-6.45,;21.79,-7.22,;21.79,-8.76,;23.12,-9.53,;24.46,-8.76,;24.46,-7.22,;23.12,-6.45,;23.12,-4.91,;23.12,-11.07,;21.85,-11.97,;24.3,-11.88,;23.12,-12.61,)|

Structure