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Assay Detail

CHEMBL1248646

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Functional
Antagonist activity against human recombinant 5HT1B receptor expressed in CHO cells assessed as inhibition of 5HT-induced [35S]GTPgammaS binding by scintillation proximity assay
29
Total Activities
28
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Homo sapiens
Cell Type CHO
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

5-hydroxytryptamine receptor 1B (CHEMBL1898)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Design and synthesis of novel tricyclic benzoxazines as potent 5-HT(1A/B/D) receptor antagonists leading to the discovery of 6-{2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl}-4H-imidazo[5,1-c][1,4]benzoxazine-3-carboxamide (GSK588045).
Bromidge SM, Arban R, Bertani B, Bison S, Borriello M, Cavanni P, Dal Forno G, Di-Fabio R, Donati D, Fontana S, Gianotti M, Gordon LJ, Granci E, Leslie CP, Moccia L, Pasquarello A, Sartori I, Sava A, Watson JM, Worby A, Zonzini L, Zucchelli V.
J Med Chem (2010) 53 : 5827 -5843
PubMed 20590088 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 28 8.76 9.30
Kd 1 8.93 8.93

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1242081 1 9.30
CHEMBL1242167 1 9.20
CHEMBL1241824 1 9.20
CHEMBL1241738 1 9.10
CHEMBL1241736 1 9.00
CHEMBL1242717 1 9.00
CHEMBL1242533 1 9.00
CHEMBL1241642 1 9.00
CHEMBL1241641 1 9.00
CHEMBL513715 1 9.00
CHEMBL1241913 2 8.93
CHEMBL1241640 1 8.90
CHEMBL1241912 1 8.90
CHEMBL1242623 1 8.80
CHEMBL1242345 1 8.80
CHEMBL1241825 1 8.80
CHEMBL1242904 1 8.80
CHEMBL1242436 1 8.80
CHEMBL1241547 1 8.80
CHEMBL1241548 1 8.70
CHEMBL522257 1 8.70
CHEMBL1242257 1 8.70
CHEMBL1241998 1 8.60
CHEMBL1241737 1 8.60
CHEMBL1241546 1 8.60
CHEMBL469345 1 8.40
CHEMBL1241639 1 8.10
CHEMBL490417 1 6.60

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1242081 Ki = 0.5012 nM 9.30
CHEMBL1242167 Ki = 0.631 nM 9.20
CHEMBL1241824 Ki = 0.631 nM 9.20
CHEMBL1241738 Ki = 0.7943 nM 9.10
CHEMBL1241641 Ki = 1.0 nM 9.00
CHEMBL513715 Ki = 1.0 nM 9.00
CHEMBL1241642 Ki = 1.0 nM 9.00
CHEMBL1242533 Ki = 1.0 nM 9.00
CHEMBL1242717 Ki = 1.0 nM 9.00
CHEMBL1241736 Ki = 1.0 nM 9.00
CHEMBL1241913 Kd = 1.175 nM 8.93
CHEMBL1241640 Ki = 1.259 nM 8.90
CHEMBL1241912 Ki = 1.259 nM 8.90
CHEMBL1242623 Ki = 1.585 nM 8.80
CHEMBL1242345 Ki = 1.585 nM 8.80
CHEMBL1241825 Ki = 1.585 nM 8.80
CHEMBL1242904 Ki = 1.585 nM 8.80
CHEMBL1242436 Ki = 1.585 nM 8.80
CHEMBL1241913 Ki = 1.585 nM 8.80
CHEMBL1241547 Ki = 1.585 nM 8.80
CHEMBL1241548 Ki = 1.995 nM 8.70
CHEMBL522257 Ki = 1.995 nM 8.70
CHEMBL1242257 Ki = 1.995 nM 8.70
CHEMBL1241998 Ki = 2.512 nM 8.60
CHEMBL1241737 Ki = 2.512 nM 8.60
CHEMBL1241546 Ki = 2.512 nM 8.60
CHEMBL469345 Ki = 3.981 nM 8.40
CHEMBL1241639 Ki = 7.943 nM 8.10
CHEMBL490417 Ki = 251.19 nM 6.60