Reaction Details |
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Target | Nuclear receptor subfamily 1 group I member 2 |
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Ligand | BDBM50264804 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1699179 (CHEMBL4050161) |
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IC50 | >30000±n/a nM |
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Citation | Cernak, T; Gesmundo, NJ; Dykstra, K; Yu, Y; Wu, Z; Shi, ZC; Vachal, P; Sperbeck, D; He, S; Murphy, BA; Sonatore, L; Williams, S; Madeira, M; Verras, A; Reiter, M; Lee, CH; Cuff, J; Sherer, EC; Kuethe, J; Goble, S; Perrotto, N; Pinto, S; Shen, DM; Nargund, R; Balkovec, J; DeVita, RJ; Dreher, SD Microscale High-Throughput Experimentation as an Enabling Technology in Drug Discovery: Application in the Discovery of (Piperidinyl)pyridinyl-1H-benzimidazole Diacylglycerol Acyltransferase 1 Inhibitors. J Med Chem60:3594-3605 (2017) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Nuclear receptor subfamily 1 group I member 2 |
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Name: | Nuclear receptor subfamily 1 group I member 2 |
Synonyms: | NR1I2 | NR1I2_HUMAN | Orphan nuclear receptor PAR1 | Orphan nuclear receptor PXR | PXR | Pregnane X receptor | SXR | Steroid and xenobiotic receptor | nuclear receptor subfamily 1 group I member 2 isoform 1 |
Type: | Nuclear receptor |
Mol. Mass.: | 49774.77 |
Organism: | Homo sapiens (Human) |
Description: | O75469 |
Residue: | 434 |
Sequence: | MEVRPKESWNHADFVHCEDTESVPGKPSVNADEEVGGPQICRVCGDKATGYHFNVMTCEG
CKGFFRRAMKRNARLRCPFRKGACEITRKTRRQCQACRLRKCLESGMKKEMIMSDEAVEE
RRALIKRKKSERTGTQPLGVQGLTEEQRMMIRELMDAQMKTFDTTFSHFKNFRLPGVLSS
GCELPESLQAPSREEAAKWSQVRKDLCSLKVSLQLRGEDGSVWNYKPPADSGGKEIFSLL
PHMADMSTYMFKGIISFAKVISYFRDLPIEDQISLLKGAAFELCQLRFNTVFNAETGTWE
CGRLSYCLEDTAGGFQQLLLEPMLKFHYMLKKLQLHEEEYVLMQAISLFSPDRPGVLQHR
VVDQLQEQFAITLKSYIECNRPQPAHRFLFLKIMAMLTELRSINAQHTQRLLRIQDIHPF
ATPLMQELFGITGS
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BDBM50264804 |
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n/a |
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Name | BDBM50264804 |
Synonyms: | CHEMBL4060355 |
Type | Small organic molecule |
Emp. Form. | C24H25F3N4O3 |
Mol. Mass. | 474.4755 |
SMILES | OC(=O)CC1CCC2(CCN(CC2)c2ccc(cn2)-c2nc3cc(ccc3[nH]2)C(F)(F)F)OC1 |
Structure |
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