Reaction Details Report a problem with these data
Target
Bile acid receptor
Ligand
BDBM50236238
Substrate
n/a
Meas. Tech.
ChEMBL_1730648 (CHEMBL4146184)
EC50
>100000±n/a nM
Citation
 Mostarda, S; Passeri, D; Carotti, A; Cerra, B; Colliva, C; Benicchi, T; Macchiarulo, A; Pellicciari, R; Gioiello, A Synthesis, physicochemical properties, and biological activity of bile acids 3-glucuronides: Novel insights into bile acid signalling and detoxification. Eur J Med Chem 144:349-358 (2018) [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:
BDBM50236238
Synonyms:
(3alpha,5beta)-3-hydroxycholan-24-oic acid | 3alpha-hydroxy-5beta-cholan-24-oic acid | 3alpha-hydroxy-5beta-cholanic acid | 3alpha-hydroxy-5beta-cholanoic acid | 5beta-cholanic acid-3alpha-ol | CHEMBL1478 | LCA | cid_9903 | lithocholic acid
Type:
Small organic molecule
Emp. Form.:
C24H40O3
Mol. Mass.:
376.5726
SMILES:
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r|
Structure:
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