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Assay Detail

CHEMBL3242257

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

Binding
Displacement of FITC-geldanamycin from recombinant HSP90beta (unknown origin) after 2 hrs by fluorescence polarization assay
38
Total Activities
38
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

Target

Heat shock protein HSP 90-beta (CHEMBL4303)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Identification of novel HSP90α/β isoform selective inhibitors using structure-based drug design. demonstration of potential utility in treating CNS disorders such as Huntington's disease.
Ernst JT, Neubert T, Liu M, Sperry S, Zuccola H, Turnbull A, Fleck B, Kargo W, Woody L, Chiang P, Tran D, Chen W, Snyder P, Alcacio T, Nezami A, Reynolds J, Alvi K, Goulet L, Stamos D.
J Med Chem (2014) 57 : 3382 -3400
PubMed 24673104 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 38 7.31 8.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3235355 1 8.52
CHEMBL3235353 1 8.30
CHEMBL3235354 1 8.30
CHEMBL3235361 1 8.00
CHEMBL3235335 1 7.92
CHEMBL3235360 1 7.82
CHEMBL3235336 1 7.72
CHEMBL3235362 1 7.70
CHEMBL3235339 1 7.68
CHEMBL3235342 1 7.66
CHEMBL3235344 1 7.66
CHEMBL3235338 1 7.60
CHEMBL3235343 1 7.60
CHEMBL3235352 1 7.58
CHEMBL3235341 1 7.54
CHEMBL3235345 1 7.52
CHEMBL3235333 1 7.51
CHEMBL3235334 1 7.46
CHEMBL3235350 1 7.43
CHEMBL3235356 1 7.41
CHEMBL3235363 1 7.40
CHEMBL3235351 1 7.40
CHEMBL3235340 1 7.32
CHEMBL3235357 1 7.25
CHEMBL3235337 1 7.22
CHEMBL3235359 1 6.92
CHEMBL3235358 1 6.85
CHEMBL3235349 1 6.38
CHEMBL3235330 1 6.24
CHEMBL3235347 1 6.23

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3235355 Ki = 3.0 nM 8.52
CHEMBL3235353 Ki = 5.0 nM 8.30
CHEMBL3235354 Ki = 5.0 nM 8.30
CHEMBL3235361 Ki = 10.0 nM 8.00
CHEMBL3235335 Ki = 12.0 nM 7.92
CHEMBL3235360 Ki = 15.0 nM 7.82
CHEMBL3235336 Ki = 19.0 nM 7.72
CHEMBL3235362 Ki = 20.0 nM 7.70
CHEMBL3235339 Ki = 21.0 nM 7.68
CHEMBL3235342 Ki = 22.0 nM 7.66
CHEMBL3235344 Ki = 22.0 nM 7.66
CHEMBL3235338 Ki = 25.0 nM 7.60
CHEMBL3235343 Ki = 25.0 nM 7.60
CHEMBL3235352 Ki = 26.0 nM 7.58
CHEMBL3235341 Ki = 29.0 nM 7.54
CHEMBL3235345 Ki = 30.0 nM 7.52
CHEMBL3235333 Ki = 31.0 nM 7.51
CHEMBL3235334 Ki = 35.0 nM 7.46
CHEMBL3235350 Ki = 37.0 nM 7.43
CHEMBL3235356 Ki = 39.0 nM 7.41
CHEMBL3235351 Ki = 40.0 nM 7.40
CHEMBL3235363 Ki = 40.0 nM 7.40
CHEMBL3235340 Ki = 48.0 nM 7.32
CHEMBL3235357 Ki = 56.0 nM 7.25
CHEMBL3235337 Ki = 60.0 nM 7.22
CHEMBL3235359 Ki = 120.0 nM 6.92
CHEMBL3235358 Ki = 140.0 nM 6.85
CHEMBL3235349 Ki = 420.0 nM 6.38
CHEMBL3235330 Ki = 580.0 nM 6.24
CHEMBL3235347 Ki = 590.0 nM 6.23
CHEMBL3235332 Ki = 1500.0 nM 5.82
CHEMBL3235328 Ki = 2600.0 nM 5.58
CHEMBL3235329 Ki = 2900.0 nM 5.54
CHEMBL3235348 Ki > 10000.0 nM -
CHEMBL3235346 Ki > 10000.0 nM -
CHEMBL3235331 Ki > 10000.0 nM -
CHEMBL3235327 Ki > 10000.0 nM -
CHEMBL3235326 Ki > 10000.0 nM -