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Target
5-hydroxytryptamine receptor 1A
Ligand
BDBM50252281
Substrate
n/a
Meas. Tech.
ChEMBL_487560 (CHEMBL1013154)
Ki
42.6±n/a nM
Citation
 Zhou, D; Zhou, P; Evrard, DA; Meagher, K; Webb, M; Harrison, BL; Huryn, DM; Golembieski, J; Hornby, GA; Schechter, LE; Smith, DL; Andree, TH; Mewshaw, RE Studies toward the discovery of the next generation of antidepressants. Part 6: Dual 5-HT1A receptor and serotonin transporter affinity within a class of arylpiperazinyl-cyclohexyl indole derivatives. Bioorg Med Chem 16:6707-23 (2008) [PubMed]  Article 
Target
Name:
5-hydroxytryptamine receptor 1A
Synonyms:
5-HT-1A | 5-HT1A | 5-hydroxytryptamine receptor 1A (5-HT-1A) | 5HT1A_HUMAN | ADRB2RL1 | ADRBRL1 | Dopamine D2 receptor and serotonin 1a receptor | G-21 | HTR1A | Serotonin receptor 1A
Type:
n/a
Mol. Mass.:
46122.49
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
422
Sequence:
MDVLSPGQGNNTTSPPAPFETGGNTTGISDVTVSYQVITSLLLGTLIFCAVLGNACVVAAIALERSLQNVANYLIGSLAVTDLMVSVLVLPMAALYQVLNKWTLGQVTCDLFIALDVLCCTSSILHLCAIALDRYWAITDPIDYVNKRTPRRAAALISLTWLIGFLISIPPMLGWRTPEDRSDPDACTISKDHGYTIYSTFGAFYIPLLLMLVLYGRIFRAARFRIRKTVKKVEKTGADTRHGASPAPQPKKSVNGESGSRNWRLGVESKAGGALCANGAVRQGDDGAALEVIEVHRVGNSKEHLPLPSEAGPTPCAPASFERKNERNAEAKRKMALARERKTVKTLGIIMGTFILCWLPFFIVALVLPFCESSCHMPTLLGAIINWLGYSNSLLNPVIYAYFNKDFQNAFKKIIKCKFCRQ
  
Inhibitor
Name:
BDBM50252281
Synonyms:
5-Fluoro-3-[(1,4-trans)-4-(4-naphthalen-1-yl-piperazin-1-yl)-cyclohexyl]-1H-indole | CHEMBL479986
Type:
Small organic molecule
Emp. Form.:
C28H30FN3
Mol. Mass.:
427.5563
SMILES:
Fc1ccc2[nH]cc([C@H]3CC[C@@H](CC3)N3CCN(CC3)c3cccc4ccccc34)c2c1 |r,wU:8.7,wD:11.14,(-1.55,5.95,;-1.24,4.44,;.22,3.95,;.52,2.44,;-.63,1.43,;-.64,-.11,;-2.12,-.57,;-3.01,.68,;-4.55,.7,;-5.33,-.63,;-6.87,-.61,;-7.62,.73,;-6.85,2.06,;-5.31,2.04,;-9.16,.74,;-9.94,-.59,;-11.49,-.58,;-12.24,.75,;-11.46,2.09,;-9.93,2.08,;-13.78,.76,;-14.56,-.57,;-16.1,-.56,;-16.87,.78,;-16.08,2.11,;-16.85,3.44,;-16.07,4.76,;-14.53,4.75,;-13.78,3.42,;-14.55,2.1,;-2.09,1.93,;-2.39,3.43,)|
Structure:
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