Target
Orexin receptor type 2
Ligand
BDBM50121794
Substrate
n/a
Meas. Tech.
ChEMBL_323054 (CHEMBL857325)
EC50
0.12±n/a nM
Citation
 Asahi, SEgashira, SMatsuda, MIwaasa, HKanatani, AOhkubo, MIhara, MMorishima, H Development of an orexin-2 receptor selective agonist, [Ala(11), D-Leu(15)]orexin-B. Bioorg Med Chem Lett 13:111-3 (2002) [PubMed]  Article 
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:
BDBM50121794
Synonyms:
CHEMBL427771 | [Ala7]orexin-B
Type:
Small organic molecule
Emp. Form.:
C120H206N44O35S
Mol. Mass.:
2857.258
SMILES:
CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](N)CCSC)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O |wU:79.79,74.75,68.68,124.124,56.56,41.41,104.104,2.2,8.12,183.185,20.20,88.88,wD:132.132,156.157,189.191,115.115,46.45,147.147,36.36,4.4,96.96,16.16,26.27,168.170,175.178,(17.13,-16.91,;17.13,-18.45,;15.8,-19.22,;14.46,-18.45,;15.8,-20.76,;17.13,-21.53,;18.46,-20.76,;18.46,-19.22,;19.8,-21.53,;19.8,-23.07,;18.46,-23.84,;18.46,-25.38,;17.13,-23.07,;21.13,-20.76,;22.46,-21.53,;22.46,-23.07,;23.8,-20.76,;25.13,-21.53,;26.47,-20.76,;26.47,-19.22,;27.81,-21.53,;29.14,-20.76,;27.81,-23.07,;26.47,-23.84,;26.48,-25.38,;25.15,-26.16,;23.8,-19.22,;25.13,-18.45,;22.46,-18.45,;14.46,-21.53,;14.46,-23.07,;13.13,-20.77,;11.8,-21.54,;10.46,-20.77,;10.46,-19.23,;9.13,-21.54,;7.8,-20.77,;7.8,-19.23,;6.46,-21.54,;6.46,-23.08,;5.13,-20.77,;3.8,-21.54,;3.8,-23.08,;2.46,-20.77,;2.46,-19.23,;1.13,-21.54,;-.2,-20.77,;-.2,-19.23,;-1.54,-18.46,;-2.77,-19.4,;-4.03,-18.53,;-3.6,-17.05,;-2.06,-17.01,;-1.54,-21.54,;-1.54,-23.08,;-2.88,-20.77,;-4.21,-21.54,;-4.21,-23.08,;-5.55,-23.85,;-6.88,-23.08,;-5.55,-25.39,;-5.55,-20.77,;-5.55,-19.23,;-6.88,-21.54,;-8.2,-20.79,;-8.2,-19.24,;-6.87,-18.47,;-9.54,-18.47,;-9.51,-16.96,;-10.8,-16.15,;-10.76,-14.61,;-8.14,-16.21,;-6.83,-17.02,;-8.11,-14.67,;-6.78,-13.9,;-6.78,-12.36,;-5.44,-14.67,;-5.44,-16.21,;-4.1,-13.9,;-4.12,-12.37,;-5.46,-11.61,;-5.47,-10.06,;-6.8,-9.3,;-8.11,-10.09,;-6.81,-7.76,;-2.77,-11.59,;-2.8,-10.05,;-1.44,-12.35,;-.11,-11.59,;-.11,-10.05,;1.23,-9.28,;1.23,-7.74,;2.56,-10.05,;1.23,-12.35,;1.23,-13.89,;2.56,-11.58,;3.89,-12.35,;3.89,-13.89,;5.23,-14.66,;5.23,-16.2,;6.56,-13.89,;5.23,-11.58,;5.23,-10.04,;6.57,-12.35,;7.9,-11.59,;7.9,-10.05,;9.24,-9.28,;9.24,-7.74,;10.58,-6.98,;11.91,-7.75,;13.24,-6.98,;11.91,-9.29,;9.24,-12.35,;9.24,-13.89,;10.56,-11.58,;11.89,-12.35,;11.89,-13.89,;13.23,-14.66,;13.23,-16.2,;14.56,-16.97,;11.89,-16.97,;13.23,-11.58,;13.23,-10.04,;14.56,-12.35,;15.89,-11.58,;15.89,-10.04,;17.23,-9.27,;17.23,-7.73,;18.56,-10.04,;17.23,-12.35,;17.23,-13.89,;18.57,-11.58,;19.9,-12.35,;19.9,-13.89,;21.24,-14.66,;21.24,-16.2,;22.57,-16.97,;23.91,-16.2,;25.24,-16.97,;23.91,-14.66,;21.24,-11.58,;21.24,-10.04,;22.57,-12.35,;23.91,-11.59,;23.91,-10.05,;22.58,-9.28,;25.24,-9.28,;25.25,-7.74,;26.59,-6.98,;26.6,-5.44,;27.94,-4.68,;27.95,-3.14,;29.27,-5.46,;23.92,-6.96,;22.58,-7.72,;23.93,-5.42,;22.6,-4.65,;22.62,-3.12,;21.26,-5.42,;21.26,-6.96,;19.93,-4.65,;18.6,-5.42,;17.27,-4.65,;15.94,-5.42,;17.27,-3.11,;18.51,-2.19,;18.04,-.73,;16.5,-.73,;16.02,-2.19,;14.69,-2.98,;14.71,-4.52,;13.35,-2.23,;12.87,-.77,;11.33,-.77,;10.85,-2.23,;12.1,-3.14,;12.1,-4.68,;13.44,-5.45,;10.76,-5.46,;9.43,-4.69,;8.09,-5.46,;8.09,-7,;6.76,-4.69,;5.43,-5.46,;5.43,-7,;4.09,-7.77,;4.09,-4.69,;4.09,-3.15,;2.76,-5.46,;1.43,-4.69,;1.43,-3.15,;.09,-2.38,;.09,-.84,;-1.23,-.07,;-2.56,-.84,;-3.89,-.07,;-2.56,-2.38,;.09,-5.46,;-1.24,-4.69,;.09,-7,)|
Structure:
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