Reaction Details Report a problem with these data
Target
Bile acid receptor
Ligand
BDBM50633069
Substrate
n/a
Meas. Tech.
ChEMBL_2374526
Kd
84±n/a nM
Citation
 Zhang, N; Fan, T; Zhao, L; Li, Y; Bao, Y; Ma, X; Mei, Y; Wang, Y; Liu, Y; Deng, H; Li, Y; He, H; Song, D Discovery and development of palmatine analogues as anti-NASH agents by activating farnesoid X receptor (FXR). Eur J Med Chem 245:0 (2023) [PubMed] 
Target
Name:
Bile acid receptor
Synonyms:
Farnesol receptor HRR-1 | Nuclear receptor subfamily 1 group H member 4 | RXR-interacting protein 14 | Retinoid X receptor-interacting protein 14 | farnesoid x receptor | NR1H4_HUMAN | NR1H4 | BAR | FXR | HRR1 | RIP14 | Bile acid receptor FXR
Type:
Nuclear Receptor
Mol. Mass.:
55916.24
Organism:
Human
Description:
Q96RI1
Residue:
486
Sequence:
MVMQFQGLENPIQISPHCSCTPSGFFMEMMSMKPAKGVLTEQVAGPLGQNLEVEPYSQYSNVQFPQVQPQISSSSYYSNLGFYPQQPEEWYSPGIYELRRMPAETLYQGETEVAEMPVTKKPRMGASAGRIKGDELCVVCGDRASGYHYNALTCEGCKGFFRRSITKNAVYKCKNGGNCVMDMYMRRKCQECRLRKCKEMGMLAECMYTGLLTEIQCKSKRLRKNVKQHADQTVNEDSEGRDLRQVTSTTKSCREKTELTPDQQTLLHFIMDSYNKQRMPQEITNKILKEEFSAEENFLILTEMATNHVQVLVEFTKKLPGFQTLDHEDQIALLKGSAVEAMFLRSAEIFNKKLPSGHSDLLEERIRNSGISDEYITPMFSFYKSIGELKMTQEEYALLTAIVILSPDRQYIKDREAVEKLQEPLLDVLQKLCKIHQPENPQHFACLLGRLTELRTFNHHHAEMLMSWRVNDHKFTPLLCEIWDVQ
  
Inhibitor
Name:
BDBM50633069
Synonyms:
CHEMBL5415777
Type:
Small organic molecule
Emp. Form.:
C28H28BrNO4
Mol. Mass.:
522.44
SMILES:
COc1ccc2cc3-c4cc(OC)c(OC)cc4CC[n+]3cc2c1OCc1cccc(C)c1
Structure:
Search PDB for entries with ligand similarity: