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Assay Detail

CHEMBL4022512

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

ADMET
Cytotoxicity against primary human endothelial keratinocytes assessed as inhibition of cell viability preincubated for 2 hrs followed by cytokine addition measured after 72 hrs by PrestoBlue staining based fluorescence assay
13
Total Activities
13
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type ADMET
Organism Homo sapiens
Cell Type Keratinocyte
Confidence 1 — Organism
Curated By Autocuration

Target

Keratinocyte (CHEMBL613995)
Type CELL-LINE

Publication

The design, synthesis, and anti-inflammatory evaluation of a drug-like library based on the natural product valerenic acid.
Egbewande FA, Nilsson N, White JM, Coster MJ, Davis RA.
Bioorg Med Chem Lett (2017) 27 : 3185 -3189
PubMed 28558967 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 13 5.33 6.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL632 BETAMETHASONE 4.0 1 6.52
CHEMBL4088435 1 5.06
CHEMBL4072446 1 5.05
CHEMBL4080571 1 5.02
CHEMBL4067177 1 5.02
CHEMBL4096155 1 -
CHEMBL4085993 1 -
CHEMBL4103910 1 -
CHEMBL4104798 1 -
CHEMBL4099378 1 -
CHEMBL4078502 1 -
CHEMBL4102786 1 -
CHEMBL1545045 VALERENIC ACID 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL632 BETAMETHASONE IC50 = 300.0 nM 6.52
CHEMBL4088435 IC50 = 8700.0 nM 5.06
CHEMBL4072446 IC50 = 9000.0 nM 5.05
CHEMBL4080571 IC50 = 9600.0 nM 5.02
CHEMBL4067177 IC50 = 9600.0 nM 5.02
CHEMBL4096155 IC50 - -
CHEMBL4085993 IC50 - -
CHEMBL4103910 IC50 - -
CHEMBL4104798 IC50 - -
CHEMBL4099378 IC50 - -
CHEMBL4078502 IC50 - -
CHEMBL4102786 IC50 - -
CHEMBL1545045 VALERENIC ACID IC50 - -