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Assay Detail

CHEMBL2378059

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Binding
Inhibition of human IKKbeta using GST-IkappaBalpha as substrate
171
Total Activities
171
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Publication

Novel IKKβ inhibitors discovery based on the co-crystal structure by using binding-conformation-based and ligand-based method.
Huang JJ, Wu XW, Jia JM, Guo XK, Xue X, Jiang ZY, Zhang SL, Zhang XJ, Sun HP, You QD.
Eur J Med Chem (2013) 63 : 269 -278
PubMed 23501112 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 171 7.10 8.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL250105 1 8.60
CHEMBL182407 1 8.52
CHEMBL249280 1 8.52
CHEMBL183703 1 8.40
CHEMBL493974 1 8.30
CHEMBL181495 1 8.30
CHEMBL181334 1 8.30
CHEMBL182749 1 8.22
CHEMBL521643 1 8.22
CHEMBL249482 1 8.15
CHEMBL549478 1 8.15
CHEMBL558491 1 8.15
CHEMBL1831200 1 8.10
CHEMBL249104 1 8.10
CHEMBL1761516 1 8.10
CHEMBL551773 1 8.10
CHEMBL2375673 1 8.07
CHEMBL400077 1 8.07
CHEMBL361233 1 8.04
CHEMBL1831202 1 8.04
CHEMBL493940 1 7.96
CHEMBL562720 1 7.96
CHEMBL390201 1 7.96
CHEMBL131693 1 7.96
CHEMBL361841 1 7.92
CHEMBL562971 1 7.92
CHEMBL1761512 1 7.90
CHEMBL398253 1 7.89
CHEMBL404609 1 7.89
CHEMBL249886 1 7.89

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL250105 IC50 = 2.512 nM 8.60
CHEMBL249280 IC50 = 3.02 nM 8.52
CHEMBL182407 IC50 = 3.02 nM 8.52
CHEMBL183703 IC50 = 3.981 nM 8.40
CHEMBL181495 IC50 = 5.012 nM 8.30
CHEMBL181334 IC50 = 5.012 nM 8.30
CHEMBL493974 IC50 = 5.012 nM 8.30
CHEMBL521643 IC50 = 6.026 nM 8.22
CHEMBL182749 IC50 = 6.026 nM 8.22
CHEMBL249482 IC50 = 7.079 nM 8.15
CHEMBL558491 IC50 = 7.079 nM 8.15
CHEMBL549478 IC50 = 7.079 nM 8.15
CHEMBL1831200 IC50 = 7.943 nM 8.10
CHEMBL551773 IC50 = 7.943 nM 8.10
CHEMBL1761516 IC50 = 7.943 nM 8.10
CHEMBL249104 IC50 = 7.943 nM 8.10
CHEMBL400077 IC50 = 8.511 nM 8.07
CHEMBL2375673 IC50 = 8.511 nM 8.07
CHEMBL1831202 IC50 = 9.12 nM 8.04
CHEMBL361233 IC50 = 9.12 nM 8.04
CHEMBL390201 IC50 = 10.96 nM 7.96
CHEMBL562720 IC50 = 10.96 nM 7.96
CHEMBL131693 IC50 = 10.96 nM 7.96
CHEMBL493940 IC50 = 10.96 nM 7.96
CHEMBL361841 IC50 = 12.02 nM 7.92
CHEMBL562971 IC50 = 12.02 nM 7.92
CHEMBL1761512 IC50 = 12.59 nM 7.90
CHEMBL404609 IC50 = 12.88 nM 7.89
CHEMBL249886 IC50 = 12.88 nM 7.89
CHEMBL398253 IC50 = 12.88 nM 7.89
CHEMBL399689 IC50 = 14.13 nM 7.85
CHEMBL181756 IC50 = 14.13 nM 7.85
CHEMBL552183 IC50 = 14.13 nM 7.85
CHEMBL182173 IC50 = 14.13 nM 7.85
CHEMBL181434 IC50 = 15.14 nM 7.82
CHEMBL182358 IC50 = 15.14 nM 7.82
CHEMBL360337 IC50 = 15.14 nM 7.82
CHEMBL2375543 IC50 = 15.14 nM 7.82
CHEMBL2375676 IC50 = 15.14 nM 7.82
CHEMBL2375677 IC50 = 15.14 nM 7.82
CHEMBL520473 IC50 = 15.85 nM 7.80
CHEMBL522014 IC50 = 15.85 nM 7.80
CHEMBL231530 IC50 = 18.2 nM 7.74
CHEMBL230184 IC50 = 18.2 nM 7.74
CHEMBL249481 IC50 = 18.2 nM 7.74
CHEMBL399688 IC50 = 19.05 nM 7.72
CHEMBL483165 IC50 = 19.95 nM 7.70
CHEMBL361548 IC50 = 19.95 nM 7.70
CHEMBL483557 IC50 = 19.95 nM 7.70
CHEMBL1761513 IC50 = 19.95 nM 7.70