Reaction Details Report a problem with these data
Target
5-hydroxytryptamine receptor 1A
Ligand
BDBM50301438
Substrate
n/a
Meas. Tech.
ChEMBL_600323 (CHEMBL1038399)
Ki
1600±n/a nM
Citation
 Herold, F; Izbicki, L; Chodkowski, A; Dawidowski, M; Król, M; Kleps, J; Turlo, J; Wolska, I; Nowak, G; Stachowicz, K; Dybala, M; Siwek, A; Nowak, M; Pieniazek, E; Jaronczyk, M; Sylte, I; Mazurek, AP Novel 4-aryl-pyrido[1,2-c]pyrimidines with dual SSRI and 5-HT1A activity: part 2. Eur J Med Chem 44:4702-15 (2009) [PubMed]  Article 
Target
Name:
5-hydroxytryptamine receptor 1A
Synonyms:
5-HT-1A | 5-HT1 | 5-HT1A | 5-Hydroxytryptamine receptor 1A (5-HT1A) | 5-hydroxytryptamine receptor 1A (5HT1A) | 5HT1A_RAT | 5ht1a | G-21 | Htr1a | Serotonin 1 (5-HT1) receptor | Serotonin 1a (5-HT1a) receptor/Adrenergic receptor alpha-1 | Serotonin receptor 1A
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
46445.29
Organism:
Rattus norvegicus (rat)
Description:
Binding assays were performed using rat hippocampal membranes.
Residue:
422
Sequence:
MDVFSFGQGNNTTASQEPFGTGGNVTSISDVTFSYQVITSLLLGTLIFCAVLGNACVVAAIALERSLQNVANYLIGSLAVTDLMVSVLVLPMAALYQVLNKWTLGQVTCDLFIALDVLCCTSSILHLCAIALDRYWAITDPIDYVNKRTPRRAAALISLTWLIGFLISIPPMLGWRTPEDRSDPDACTISKDHGYTIYSTFGAFYIPLLLMLVLYGRIFRAARFRIRKTVRKVEKKGAGTSLGTSSAPPPKKSLNGQPGSGDWRRCAENRAVGTPCTNGAVRQGDDEATLEVIEVHRVGNSKEHLPLPSESGSNSYAPACLERKNERNAEAKRKMALARERKTVKTLGIIMGTFILCWLPFFIVALVLPFCESSCHMPALLGAIINWLGYSNSLLNPVIYAYFNKDFQNAFKKIIKCKFCRR
  
Inhibitor
Name:
BDBM50301438
Synonyms:
4-(2-Methoxy-phenyl)-2-{4-[4-(2-methyl-1H-indol-3-yl)-piperidin-1-yl]-butyl}-5,6,7,8-tetrahydro-pyrido[1,2-c]pyrimidine-1,3-dione | CHEMBL569474
Type:
Small organic molecule
Emp. Form.:
C33H40N4O3
Mol. Mass.:
540.6957
SMILES:
COc1ccccc1-c1c2CCCCn2c(=O)n(CCCCN2CCC(CC2)c2c(C)[nH]c3ccccc23)c1=O |(22.4,-17.18,;21.07,-17.96,;19.73,-17.19,;19.73,-15.64,;18.39,-14.87,;17.06,-15.64,;17.06,-17.19,;18.39,-17.96,;18.39,-19.5,;17.05,-20.27,;15.74,-19.5,;14.41,-20.26,;14.4,-21.79,;15.73,-22.56,;17.05,-21.8,;18.38,-22.58,;18.37,-24.12,;19.72,-21.81,;21.05,-22.59,;22.38,-21.83,;23.71,-22.6,;25.05,-21.84,;26.38,-22.62,;26.36,-24.15,;27.69,-24.93,;29.03,-24.17,;29.04,-22.63,;27.71,-21.84,;30.35,-24.95,;30.51,-26.48,;29.36,-27.51,;32.01,-26.82,;32.79,-25.49,;34.29,-25.19,;34.79,-23.74,;33.77,-22.58,;32.26,-22.89,;31.77,-24.34,;19.73,-20.27,;21.06,-19.5,)|
Structure:
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