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Assay Detail

CHEMBL5583272

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

Binding
Inhibition of NLRP3 in PMA-differentiated human THP-1 cells assessed as inhibition of LPS/nigericin induced IL-1beta production by ELISA
55
Total Activities
55
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type THP-1
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

NACHT, LRR and PYD domains-containing protein 3 (CHEMBL1741208)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Design, Synthesis, and Bioevaluation of Novel NLRP3 Inhibitor with IBD Immunotherapy from the Virtual Screen.
Zhang Z, Wu H, Yin K, Zheng X, Cao Z, Guo W, Zhao C, Gu X.
J Med Chem (2024) 67 : 16612 -16634
PubMed 39269610 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 55 5.62 7.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3183703 1 7.92
CHEMBL5591066 1 6.58
CHEMBL5591726 1 6.37
CHEMBL5590770 1 6.17
CHEMBL5590073 1 6.15
CHEMBL5595030 1 6.09
CHEMBL5590187 1 6.02
CHEMBL5592068 1 5.99
CHEMBL5596006 1 5.97
CHEMBL5592969 1 5.73
CHEMBL5593521 1 5.39
CHEMBL5595876 1 5.37
CHEMBL5595046 1 5.36
CHEMBL5595175 1 5.36
CHEMBL5592483 1 5.30
CHEMBL5591774 1 5.29
CHEMBL5592212 1 5.16
CHEMBL5595491 1 5.14
CHEMBL5593090 1 5.12
CHEMBL5594085 1 5.10
CHEMBL5593101 1 5.01
CHEMBL5593950 1 5.00
CHEMBL5592009 1 4.76
CHEMBL62044 1 4.56
CHEMBL5583769 1 -
CHEMBL5591264 1 -
CHEMBL5591334 1 -
CHEMBL5591402 1 -
CHEMBL5595603 1 -
CHEMBL5593191 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3183703 IC50 = 12.0 nM 7.92
CHEMBL5591066 IC50 = 260.0 nM 6.58
CHEMBL5591726 IC50 = 430.0 nM 6.37
CHEMBL5590770 IC50 = 680.0 nM 6.17
CHEMBL5590073 IC50 = 710.0 nM 6.15
CHEMBL5595030 IC50 = 810.0 nM 6.09
CHEMBL5590187 IC50 = 960.0 nM 6.02
CHEMBL5592068 IC50 = 1020.0 nM 5.99
CHEMBL5596006 IC50 = 1070.0 nM 5.97
CHEMBL5592969 IC50 = 1880.0 nM 5.73
CHEMBL5593521 IC50 = 4070.0 nM 5.39
CHEMBL5595876 IC50 = 4310.0 nM 5.37
CHEMBL5595046 IC50 = 4340.0 nM 5.36
CHEMBL5595175 IC50 = 4420.0 nM 5.36
CHEMBL5592483 IC50 = 5030.0 nM 5.30
CHEMBL5591774 IC50 = 5190.0 nM 5.29
CHEMBL5592212 IC50 = 6930.0 nM 5.16
CHEMBL5595491 IC50 = 7310.0 nM 5.14
CHEMBL5593090 IC50 = 7670.0 nM 5.12
CHEMBL5594085 IC50 = 7880.0 nM 5.10
CHEMBL5593101 IC50 = 9740.0 nM 5.01
CHEMBL5593950 IC50 = 9890.0 nM 5.00
CHEMBL5592009 IC50 = 17400.0 nM 4.76
CHEMBL62044 IC50 = 27300.0 nM 4.56
CHEMBL5595666 IC50 > 10000.0 nM -
CHEMBL5590194 IC50 > 10000.0 nM -
CHEMBL5594368 IC50 > 10000.0 nM -
CHEMBL5592767 IC50 > 10000.0 nM -
CHEMBL5594957 IC50 > 10000.0 nM -
CHEMBL5592777 IC50 > 10000.0 nM -
CHEMBL5583735 IC50 > 10000.0 nM -
CHEMBL5592142 IC50 > 10000.0 nM -
CHEMBL5593730 IC50 > 10000.0 nM -
CHEMBL5594303 IC50 > 10000.0 nM -
CHEMBL5591887 IC50 > 10000.0 nM -
CHEMBL5593527 IC50 > 10000.0 nM -
CHEMBL5592332 IC50 > 10000.0 nM -
CHEMBL5593637 IC50 > 10000.0 nM -
CHEMBL5595419 IC50 > 10000.0 nM -
CHEMBL5592662 IC50 > 10000.0 nM -
CHEMBL5589977 IC50 > 10000.0 nM -
CHEMBL5589633 IC50 > 10000.0 nM -
CHEMBL5593889 IC50 > 10000.0 nM -
CHEMBL5594976 IC50 > 10000.0 nM -
CHEMBL5593191 IC50 > 10000.0 nM -
CHEMBL5595603 IC50 > 10000.0 nM -
CHEMBL5591402 IC50 > 10000.0 nM -
CHEMBL5591334 IC50 > 10000.0 nM -
CHEMBL5591264 IC50 > 10000.0 nM -
CHEMBL5583769 IC50 > 10000.0 nM -