Ki Summary

Reaction Details

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Target

5-hydroxytryptamine receptor 1A

Ligand

BDBM50063288

Substrate

n/a

Meas. Tech.

ChEMBL_1451 (CHEMBL616575)

4.7±n/a nM

Citation

Wustrow, D; Belliotti, T; Glase, S; Kesten, SR; Johnson, D; Colbry, N; Rubin, R; Blackburn, A; Akunne, H; Corbin, A; Davis, MD; Georgic, L; Whetzel, S; Zoski, K; Heffner, T; Pugsley, T; Wise, L Aminopyrimidines with high affinity for both serotonin and dopamine receptors. J Med Chem 41:760-71 (1998) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

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:

BDBM50063288

Synonyms:

CHEMBL165047 | Methyl-{4-[2-(4-phenyl-piperazin-1-yl)-ethyl]-cyclohexyl}-pyrimidin-2-yl-amine

Type:

Small organic molecule

Emp. Form.:

C23H33N5

Mol. Mass.:

379.5416

SMILES:

CN([C@H]1CC[C@H](CCN2CCN(CC2)c2ccccc2)CC1)c1ncccn1 |wU:2.1,wD:5.5,(2.36,-7.7,;3.06,-6.33,;4.6,-6.26,;5.31,-4.88,;6.85,-4.81,;7.69,-6.11,;9.22,-6.03,;10.06,-7.32,;11.6,-7.25,;12.3,-5.87,;13.84,-5.8,;14.68,-7.08,;13.98,-8.46,;12.44,-8.54,;16.22,-7,;16.9,-5.63,;18.43,-5.54,;19.28,-6.83,;18.58,-8.19,;17.05,-8.28,;6.99,-7.48,;5.45,-7.55,;2.22,-5.03,;.7,-5.12,;-.14,-3.82,;.56,-2.44,;2.1,-2.37,;2.94,-3.67,)|

Structure: