Reaction Details Report a problem with these data
Target
Nuclear receptor subfamily 1 group I member 2
Ligand
BDBM50394618
Substrate
n/a
Meas. Tech.
ChEMBL_872345 (CHEMBL2187816)
EC50
678±n/a nM
Citation
 Liu, P; Lanza, TJ; Chioda, M; Jones, C; Chobanian, HR; Guo, Y; Chang, L; Kelly, TM; Kan, Y; Palyha, O; Guan, XM; Marsh, DJ; Metzger, JM; Ramsay, K; Wang, SP; Strack, AM; Miller, R; Pang, J; Lyons, K; Dragovic, J; Ning, JG; Schafer, WA; Welch, CJ; Gong, X; Gao, YD; Hornak, V; Ball, RG; Tsou, N; Reitman, ML; Wyvratt, MJ; Nargund, RP; Lin, LS Discovery of benzodiazepine sulfonamide-based bombesin receptor subtype 3 agonists and their unusual chirality. ACS Med Chem Lett 2:933-937 (2011) [PubMed]  Article 
Target
Name:
Nuclear receptor subfamily 1 group I member 2
Synonyms:
Orphan nuclear receptor PAR1 | Orphan nuclear receptor PXR | SXR | Steroid and xenobiotic receptor | nuclear receptor subfamily 1 group I member 2 isoform 1 | NR1I2_HUMAN | NR1I2 | PXR | Pregnane X receptor
Type:
Nuclear receptor
Mol. Mass.:
49774.77
Organism:
Human
Description:
O75469
Residue:
434
Sequence:
MEVRPKESWNHADFVHCEDTESVPGKPSVNADEEVGGPQICRVCGDKATGYHFNVMTCEGCKGFFRRAMKRNARLRCPFRKGACEITRKTRRQCQACRLRKCLESGMKKEMIMSDEAVEERRALIKRKKSERTGTQPLGVQGLTEEQRMMIRELMDAQMKTFDTTFSHFKNFRLPGVLSSGCELPESLQAPSREEAAKWSQVRKDLCSLKVSLQLRGEDGSVWNYKPPADSGGKEIFSLLPHMADMSTYMFKGIISFAKVISYFRDLPIEDQISLLKGAAFELCQLRFNTVFNAETGTWECGRLSYCLEDTAGGFQQLLLEPMLKFHYMLKKLQLHEEEYVLMQAISLFSPDRPGVLQHRVVDQLQEQFAITLKSYIECNRPQPAHRFLFLKIMAMLTELRSINAQHTQRLLRIQDIHPFATPLMQELFGITGS
  
Inhibitor
Name:
BDBM50394618
Synonyms:
CHEMBL2164575
Type:
Small organic molecule
Emp. Form.:
C25H26F3N3O2S
Mol. Mass.:
489.17
SMILES:
Cc1ccc2Nc3nc(ccc3CN(c2c1C)S(=O)(=O)c1ccc(cc1)C(C)(C)C)C(F)(F)F
Structure:
Search PDB for entries with ligand similarity: