Reaction Details Report a problem with these data
Target
D(2) dopamine receptor
Ligand
BDBM50290229
Substrate
n/a
Meas. Tech.
ChEBML_58455
Ki
71±n/a nM
Citation
 Belliotti, TR; Kesten, SR; Rubin, JR; Wustrow, DJ; Georgic, LM; Zoski, KT; Akunne, HC; Wise, LD Novel cyclohexyl amides as potent and selective D3 dopamine receptor ligands Bioorg Med Chem Lett 7:2403-2408 (1997)    Article 
Target
Name:
D(2) dopamine receptor
Synonyms:
D(2) dopamine receptor | DOPAMINE D2 | DOPAMINE D2 Long | DOPAMINE D2 Short | DRD2 | DRD2_HUMAN | Dopamine D2 receptor | Dopamine D2 receptor (D2) | Dopamine D2 receptor (D2R) | Dopamine D2A | Dopamine2-like | d2
Type:
Cell-surface receptors
Mol. Mass.:
50647.10
Organism:
Homo sapiens (Human)
Description:
P14416
Residue:
443
Sequence:
MDPLNLSWYDDDLERQNWSRPFNGSDGKADRPHYNYYATLLTLLIAVIVFGNVLVCMAVSREKALQTTTNYLIVSLAVADLLVATLVMPWVVYLEVVGEWKFSRIHCDIFVTLDVMMCTASILNLCAISIDRYTAVAMPMLYNTRYSSKRRVTVMISIVWVLSFTISCPLLFGLNNADQNECIIANPAFVVYSSIVSFYVPFIVTLLVYIKIYIVLRRRRKRVNTKRSSRAFRAHLRAPLKGNCTHPEDMKLCTVIMKSNGSFPVNRRRVEAARRAQELEMEMLSSTSPPERTRYSPIPPSHHQLTLPDPSHHGLHSTPDSPAKPEKNGHAKDHPKIAKIFEIQTMPNGKTRTSLKTMSRRKLSQQKEKKATQMLAIVLGVFIICWLPFFITHILNIHCDCNIPPVLYSAFTWLGYVNSAVNPIIYTTFNIEFRKAFLKILHC
  
Inhibitor
Name:
BDBM50290229
Synonyms:
CHEMBL78406 | PD-137557 | Thiophene-2-carboxylic acid {4-[2-(4-pyridin-2-yl-piperazin-1-yl)-ethyl]-cyclohexyl}-amide
Type:
Small organic molecule
Emp. Form.:
C22H30N4OS
Mol. Mass.:
398.565
SMILES:
O=C(N[C@H]1CC[C@H](CCN2CCN(CC2)c2ccccn2)CC1)c1cccs1 |wU:3.2,wD:6.6,(5.88,-2.66,;5.57,-4.16,;6.69,-5.2,;8.16,-4.71,;8.48,-3.22,;9.95,-2.75,;11.09,-3.78,;12.56,-3.32,;13.68,-4.36,;15.15,-3.88,;16.29,-4.92,;17.74,-4.46,;18.08,-2.96,;16.95,-1.92,;15.48,-2.38,;19.55,-2.49,;20.67,-3.53,;22.14,-3.08,;22.47,-1.57,;21.33,-.52,;19.87,-.99,;10.76,-5.29,;9.3,-5.75,;4.09,-4.64,;3.62,-6.1,;2.08,-6.1,;1.62,-4.64,;2.85,-3.74,)|
Structure:
Search PDB for entries with ligand similarity: