Reaction Details Report a problem with these data
Target
D(2) dopamine receptor
Ligand
BDBM50290227
Substrate
n/a
Meas. Tech.
ChEBML_58455
Ki
11±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:
BDBM50290227
Synonyms:
3-Methyl-thiophene-2-carboxylic acid (4-{2-[4-(2,3-dichloro-phenyl)-piperazin-1-yl]-ethyl}-cyclohexyl)-amide | CHEMBL309336
Type:
Small organic molecule
Emp. Form.:
C24H31Cl2N3OS
Mol. Mass.:
480.493
SMILES:
Cc1ccsc1C(=O)N[C@H]1CC[C@H](CCN2CCN(CC2)c2cccc(Cl)c2Cl)CC1 |wU:12.13,wD:9.9,(1.34,-11.39,;2.88,-11.42,;4.72,-13.34,;5.83,-12.28,;5.47,-10.78,;4,-10.37,;3.22,-9.03,;1.68,-9.04,;3.97,-7.7,;5.53,-7.68,;6.28,-9.01,;7.82,-9.01,;8.61,-7.68,;10.15,-7.68,;10.9,-6.33,;12.44,-6.31,;13.25,-7.61,;14.79,-7.58,;15.52,-6.24,;14.73,-4.93,;13.19,-4.95,;17.06,-6.21,;17.86,-7.54,;19.4,-7.5,;20.14,-6.14,;19.33,-4.83,;20.07,-3.48,;17.8,-4.86,;16.99,-3.55,;7.82,-6.35,;6.28,-6.35,)|
Structure:
Search PDB for entries with ligand similarity: