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Assay Detail

CHEMBL5733259

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

Binding
calcium assay: Capsaicin (0.3 μM) caused an increase in [Ca2+] in the vast majority (95%) of dorsal root ganglia neurons, which were thereby identified as TRPV1 expressing neurons. All synthesized derivatives were tested and all were able to inhibit the calcium uptake and several compounds exhibited more than 80% inhibition, e.g. compounds of Examples 1, 3, 4, 5, 6, 10, 11, 12, 13, 16, 19, 23, 31, 32, 35, 36, 39, 41, 45, 46, 47, 48, 51, 53, 67, 68, 69, 70, 71, 74, 75, 78, 80, 81, 82, 86, 87 and 89. Among them, derivatives such as compounds of Examples 4, 5, 6, 13, 19, 31, 36, 39, 45, 46, 47, 48, 51, 52, 53, 67, 70, 71, 74, 75, 78, 80, 81, 86 and 87, appeared the most potent TRPV1 antagonists exhibiting a complete abolition of capsaicin response (around 100%) at 300 nM.
75
Total Activities
25
Compounds Tested
3
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Rattus norvegicus
Confidence 9 — Direct single protein target
Curated By Autocuration

Publication

TRPV1 vanilloid receptor antagonists with a bicyclic portion
(2019)

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 25 8.35 10.00
kon 25 - -
k_off 25 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL6042549 3 10.00
CHEMBL5945302 3 9.89
CHEMBL6030464 3 9.29
CHEMBL5818861 3 9.21
CHEMBL5797308 3 9.15
CHEMBL5937077 3 9.08
CHEMBL6009909 3 9.00
CHEMBL6009304 3 8.74
CHEMBL6012343 3 8.74
CHEMBL5765420 3 8.72
CHEMBL5973765 3 8.52
CHEMBL5892655 3 8.39
CHEMBL5759204 3 8.22
CHEMBL5765985 3 8.22
CHEMBL5866538 3 8.05
CHEMBL5913103 3 8.02
CHEMBL6055195 3 7.92
CHEMBL6004883 3 7.92
CHEMBL6013464 3 7.77
CHEMBL5900327 3 7.70
CHEMBL5921112 3 7.70
CHEMBL5762838 3 7.27
CHEMBL6005455 3 7.10
CHEMBL5965313 3 7.04
CHEMBL5747901 3 6.97

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL6042549 IC50 = 0.1 nM 10.00
CHEMBL5945302 IC50 = 0.13 nM 9.89
CHEMBL6030464 IC50 = 0.51 nM 9.29
CHEMBL5818861 IC50 = 0.61 nM 9.21
CHEMBL5797308 IC50 = 0.7 nM 9.15
CHEMBL5937077 IC50 = 0.84 nM 9.08
CHEMBL6009909 IC50 = 1.0 nM 9.00
CHEMBL6012343 IC50 = 1.8 nM 8.74
CHEMBL6009304 IC50 = 1.8 nM 8.74
CHEMBL5765420 IC50 = 1.9 nM 8.72
CHEMBL5973765 IC50 = 3.0 nM 8.52
CHEMBL5892655 IC50 = 4.07 nM 8.39
CHEMBL5765985 IC50 = 6.0 nM 8.22
CHEMBL5759204 IC50 = 6.0 nM 8.22
CHEMBL5866538 IC50 = 9.0 nM 8.05
CHEMBL5913103 IC50 = 9.5 nM 8.02
CHEMBL6004883 IC50 = 12.0 nM 7.92
CHEMBL6055195 IC50 = 12.0 nM 7.92
CHEMBL6013464 IC50 = 17.0 nM 7.77
CHEMBL5921112 IC50 = 19.8 nM 7.70
CHEMBL5900327 IC50 = 20.0 nM 7.70
CHEMBL5762838 IC50 = 54.0 nM 7.27
CHEMBL6005455 IC50 = 79.0 nM 7.10
CHEMBL5965313 IC50 = 92.0 nM 7.04
CHEMBL5747901 IC50 = 108.0 nM 6.97
CHEMBL5762838 kon = - -
CHEMBL5762838 k_off = - s-1 -
CHEMBL6013464 kon = - -
CHEMBL6013464 k_off = - s-1 -
CHEMBL5866538 kon = - -
CHEMBL5866538 k_off = - s-1 -
CHEMBL5921112 kon = - -
CHEMBL5921112 k_off = - s-1 -
CHEMBL5747901 kon = - -
CHEMBL5892655 kon = - -
CHEMBL5892655 k_off = - s-1 -
CHEMBL6009909 kon = - -
CHEMBL5818861 k_off = - s-1 -
CHEMBL5818861 kon = - -
CHEMBL5945302 kon = - -
CHEMBL5937077 kon = - -
CHEMBL6012343 k_off = - s-1 -
CHEMBL6012343 kon = - -
CHEMBL5937077 k_off = - s-1 -
CHEMBL5965313 kon = - -
CHEMBL5765985 k_off = - s-1 -
CHEMBL5965313 k_off = - s-1 -
CHEMBL6055195 kon = - -
CHEMBL6055195 k_off = - s-1 -
CHEMBL5765985 kon = - -