Reaction Details Report a problem with these data
Target
Orexin receptor type 2
Ligand
BDBM559675
Substrate
n/a
Meas. Tech.
IP-One Assay
IC50
0.10±n/a nM
Citation
 L., BS; Ping, C; James, CD; Jian, L; T., RM; Li, X; Dexi, Y; Shishi, L 3-AMINO PYRROLIDINE AND PIPERIDINE MACROCYCLIC OREXIN RECEPTOR AGONISTS WIPO 0:0 (2022) [PubMed] 
Target
Name:
Orexin receptor type 2
Synonyms:
HCRTR2 | Hypocretin receptor type 2 | OX2R_HUMAN | Orexin receptor type 2 (OR 2) | Orexin receptor type 2 (OR-2) | Orexin receptor type 2 (OX2) | Orexin receptor type 2 (OX2R) | Orexin receptor type 2 (OxR2) | Ox-2-R | Ox2-R
Type:
Protein
Mol. Mass.:
50710.53
Organism:
Homo sapiens (Human)
Description:
O43614
Residue:
444
Sequence:
MSGTKLEDSPPCRNWSSASELNETQEPFLNPTDYDDEEFLRYLWREYLHPKEYEWVLIAGYIIVFVVALIGNVLVCVAVWKNHHMRTVTNYFIVNLSLADVLVTITCLPATLVVDITETWFFGQSLCKVIPYLQTVSVSVSVLTLSCIALDRWYAICHPLMFKSTAKRARNSIVIIWIVSCIIMIPQAIVMECSTVFPGLANKTTLFTVCDERWGGEIYPKMYHICFFLVTYMAPLCLMVLAYLQIFRKLWCRQIPGTSSVVQRKWKPLQPVSQPRGPGQPTKSRMSAVAAEIKQIRARRKTARMLMIVLLVFAICYLPISILNVLKRVFGMFAHTEDRETVYAWFTFSHWLVYANSAANPIIYNFLSGKFREEFKAAFSCCCLGVHHRQEDRLTRGRTSTESRKSLTTQISNFDNISKLSEQVVLTSISTLPAANGAGPLQNW
  
Inhibitor
Name:
BDBM559675
Synonyms:
WO2022109117, Example 20
Type:
Small organic molecule
Emp. Form.:
C24H37N3O5S
Mol. Mass.:
479.633
SMILES:
C[C@@H]1C[C@H](NS(=O)(=O)N(C)C)[C@@H]2CO[C@H]3CC[C@H](CC3)c3cccc(OCCCC(=O)N12)c3 |wU:14.14,17.16,wD:1.0,3.3,11.33,(16.31,5.89,;15.93,4.42,;16.91,3.25,;16.1,1.97,;16.66,.56,;18.16,.34,;18.38,1.84,;17.95,-1.16,;19.67,.12,;20.23,-1.29,;20.61,1.32,;14.63,2.34,;14.14,.84,;13.1,-.39,;11.49,-.71,;10.16,-1.55,;8.74,-.97,;8.53,.58,;9.82,1.42,;11.19,.79,;7.42,1.77,;5.85,1.87,;5.14,3.21,;5.88,4.53,;7.43,4.49,;8.3,5.76,;9.6,6.59,;11.14,6.76,;12.62,6.31,;13.82,5.29,;15.01,6.23,;14.53,3.86,;8.15,3.13,)|
Structure:
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