Reaction Details Report a problem with these data
Target
Bile acid receptor
Ligand
BDBM50191406
Substrate
n/a
Meas. Tech.
ChEMBL_967650 (CHEMBL2399380)
IC50
3400±n/a nM
Citation
 Yu, DD; Lin, W; Chen, T; Forman, BM Development of time resolved fluorescence resonance energy transfer-based assay for FXR antagonist discovery. Bioorg Med Chem 21:4266-78 (2013) [PubMed]  Article 
Target
Name:
Bile acid receptor
Synonyms:
BAR | Bile acid receptor FXR | FXR | Farnesol receptor HRR-1 | HRR1 | NR1H4 | NR1H4_HUMAN | Nuclear receptor subfamily 1 group H member 4 | RIP14 | RXR-interacting protein 14 | Retinoid X receptor-interacting protein 14 | farnesoid x receptor
Type:
Nuclear Receptor
Mol. Mass.:
55916.24
Organism:
Homo sapiens (Human)
Description:
Q96RI1
Residue:
486
Sequence:
MVMQFQGLENPIQISPHCSCTPSGFFMEMMSMKPAKGVLTEQVAGPLGQNLEVEPYSQYSNVQFPQVQPQISSSSYYSNLGFYPQQPEEWYSPGIYELRRMPAETLYQGETEVAEMPVTKKPRMGASAGRIKGDELCVVCGDRASGYHYNALTCEGCKGFFRRSITKNAVYKCKNGGNCVMDMYMRRKCQECRLRKCKEMGMLAECMYTGLLTEIQCKSKRLRKNVKQHADQTVNEDSEGRDLRQVTSTTKSCREKTELTPDQQTLLHFIMDSYNKQRMPQEITNKILKEEFSAEENFLILTEMATNHVQVLVEFTKKLPGFQTLDHEDQIALLKGSAVEAMFLRSAEIFNKKLPSGHSDLLEERIRNSGISDEYITPMFSFYKSIGELKMTQEEYALLTAIVILSPDRQYIKDREAVEKLQEPLLDVLQKLCKIHQPENPQHFACLLGRLTELRTFNHHHAEMLMSWRVNDHKFTPLLCEIWDVQ
  
Inhibitor
Name:
BDBM50191406
Synonyms:
(Z)-6'-Bromo-1H,1'H-[2,3']biindolylidene-3,2'-dione 3-oxime | 6-bromoindirubin-3'-oxime
Type:
Small organic molecule
Emp. Form.:
C16H10BrN3O2
Mol. Mass.:
356.174
SMILES:
Oc1[nH]c2cc(Br)ccc2c1-c1[nH]c2ccccc2c1N=O |(23.36,-3.09,;23.85,-1.62,;25.3,-1.15,;25.3,.39,;26.44,1.42,;26.12,2.93,;27.21,4.03,;24.65,3.4,;23.52,2.36,;23.85,.86,;22.94,-.38,;21.4,-.38,;20.49,-1.64,;19.02,-1.15,;17.67,-1.92,;16.34,-1.15,;16.34,.39,;17.67,1.16,;19.02,.39,;20.49,.88,;20.96,2.33,;19.93,3.48,)|
Structure:
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