Reaction Details Report a problem with these data
Target
Motilin receptor
Ligand
BDBM50421366
Substrate
n/a
Meas. Tech.
ChEMBL_122665 (CHEMBL732795)
pH
2.5±n/a
IC50
302±n/a nM
Comments
extracted
Citation
  TBA Bioorg Med Chem Lett 5:835-838 (1995)    Article 
Target
Name:
Motilin receptor
Synonyms:
G-protein coupled receptor 38 | GPR38 | MLNR | MTLR | MTLR1 | MTLR_HUMAN
Type:
PROTEIN
Mol. Mass.:
45365.95
Organism:
Homo sapiens (Human)
Description:
ChEMBL_122664
Residue:
412
Sequence:
MGSPWNGSDGPEGAREPPWPALPPCDERRCSPFPLGALVPVTAVCLCLFVVGVSGNVVTVMLIGRYRDMRTTTNLYLGSMAVSDLLILLGLPFDLYRLWRSRPWVFGPLLCRLSLYVGEGCTYATLLHMTALSVERYLAICRPLRARVLVTRRRVRALIAVLWAVALLSAGPFLFLVGVEQDPGISVVPGLNGTARIASSPLASSPPLWLSRAPPPSPPSGPETAEAAALFSRECRPSPAQLGALRVMLWVTTAYFFLPFLCLSILYGLIGRELWSSRRPLRGPAASGRERGHRQTVRVLLVVVLAFIICWLPFHVGRIIYINTEDSRMMYFSQYFNIVALQLFYLSASINPILYNLISKKYRAAAFKLLLARKSRPRGFHRSRDTAGEVAGDTGGDTVGYTETSANVKTMG
  
Inhibitor
Name:
BDBM50421366
Synonyms:
CHEMBL353526
Type:
Small organic molecule
Emp. Form.:
C37H65NO12
Mol. Mass.:
715.9115
SMILES:
CCC1OC(=O)C(C)C(C[C@@H](OC2OC(C)CC([C@H]2O)N(C)CC)[C@]2(C)CC(C)=C(O2)[C@H](C)[C@@H](O)[C@]1(C)O)OC1C[C@@](C)(OC)[C@@H](O)C(C)O1 |wU:35.39,41.44,wD:10.10,18.19,33.35,41.45,45.48,35.38,24.25,31.33,c:29,(5,-10.02,;5.02,-8.48,;6.11,-7.38,;6.1,-8.92,;7.43,-9.69,;7.42,-11.23,;8.76,-8.92,;10.09,-9.69,;8.75,-7.38,;10.08,-6.6,;10.08,-5.06,;11.41,-4.28,;12.74,-3.51,;14.07,-4.27,;15.4,-3.5,;16.73,-4.27,;15.4,-1.96,;14.05,-1.19,;12.72,-1.97,;11.39,-1.2,;14.05,.35,;15.38,1.14,;12.72,1.11,;12.7,2.65,;8.87,-4.11,;10.25,-3.44,;8.87,-2.57,;7.54,-1.82,;7.52,-.28,;6.21,-2.6,;6.96,-3.93,;6.21,-4.14,;4.88,-3.36,;4.88,-4.91,;3.55,-4.14,;4.88,-6.45,;4.48,-7.93,;3.55,-5.68,;10.08,-8.15,;11.41,-8.92,;11.41,-10.45,;12.72,-11.22,;11.39,-11.98,;14.05,-11.99,;14.05,-13.53,;14.07,-10.46,;15.4,-11.23,;14.07,-8.92,;15.4,-8.15,;12.74,-8.15,)|
Structure:
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