Reaction Details Report a problem with these data
Target
5-hydroxytryptamine receptor 1D
Ligand
BDBM50083120
Substrate
n/a
Meas. Tech.
ChEMBL_1700 (CHEMBL616907)
IC50
0.5±n/a nM
Citation
 Russell, MG; Matassa, VG; Pengilley, RR; van Niel, MB; Sohal, B; Watt, AP; Hitzel, L; Beer, MS; Stanton, JA; Broughton, HB; Castro, JL 3-[3-(Piperidin-1-yl)propyl]indoles as highly selective h5-HT(1D) receptor agonists. J Med Chem 42:4981-5001 (2000) [PubMed]  Article 
Target
Name:
5-hydroxytryptamine receptor 1D
Synonyms:
5-HT-1D | 5-HT-1D-alpha | 5-HT1D | 5-hydroxytryptamine receptor 1D (5-HT1D) | 5HT1D_HUMAN | HTR1D | HTR1DA | HTRL | Serotonin (5-HT) receptor | Serotonin Receptor 1D
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
41920.63
Organism:
Homo sapiens (Human)
Description:
Receptor binding assays were performed using human clone stably expressed in CHO cells.
Residue:
377
Sequence:
MSPLNQSAEGLPQEASNRSLNATETSEAWDPRTLQALKISLAVVLSVITLATVLSNAFVLTTILLTRKLHTPANYLIGSLATTDLLVSILVMPISIAYTITHTWNFGQILCDIWLSSDITCCTASILHLCVIALDRYWAITDALEYSKRRTAGHAATMIAIVWAISICISIPPLFWRQAKAQEEMSDCLVNTSQISYTIYSTCGAFYIPSVLLIILYGRIYRAARNRILNPPSLYGKRFTTAHLITGSAGSSLCSLNSSLHEGHSHSAGSPLFFNHVKIKLADSALERKRISAARERKATKILGIILGAFIICWLPFFVVSLVLPICRDSCWIHPALFDFFTWLGYLNSLINPIIYTVFNEEFRQAFQKIVPFRKAS
  
Inhibitor
Name:
BDBM50083120
Synonyms:
CHEMBL148233 | Methyl-(3-methyl-but-2-enyl)-{1-[3-(5-[1,2,4]triazol-4-yl-1H-indol-3-yl)-propyl]-piperidin-4-yl}-amine
Type:
Small organic molecule
Emp. Form.:
C24H34N6
Mol. Mass.:
406.567
SMILES:
CN(CC=C(C)C)C1CCN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1 |(18.82,-5.86,;17.8,-4.72,;18.27,-3.25,;19.77,-2.93,;20.23,-1.45,;21.74,-1.13,;19.21,-.32,;16.29,-5.04,;15.81,-6.5,;14.32,-6.84,;13.3,-5.68,;11.79,-6.02,;11.32,-7.5,;9.82,-7.82,;9.37,-9.29,;10.29,-10.54,;9.37,-11.8,;7.89,-11.32,;6.55,-12.09,;5.23,-11.32,;5.23,-9.78,;6.55,-9.02,;7.89,-9.78,;3.89,-9.02,;3.73,-7.48,;2.22,-7.16,;1.45,-8.5,;2.5,-9.65,;13.75,-4.23,;15.26,-3.91,)|
Structure:
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