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Assay Detail

CHEMBL4135523

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

ADMET
Displacement of FITC-GDA from Hsp90alpha (unknown origin) after 24 hrs by fluorescence polarization assay
20
Total Activities
20
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Heat shock protein HSP 90-alpha (CHEMBL3880)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Resorcinol-Based Grp94-Selective Inhibitors.
Khandelwal A, Crowley VM, Blagg BSJ.
ACS Med Chem Lett (2017) 8 : 1013 -1018
PubMed 29057043 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 20 7.14 7.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4168598 1 7.60
CHEMBL4160774 1 7.58
CHEMBL4169566 1 7.54
CHEMBL4177418 1 7.51
CHEMBL4165495 1 7.47
CHEMBL4175693 1 7.43
CHEMBL4162694 1 7.40
CHEMBL4165074 1 7.28
CHEMBL4170618 1 7.22
CHEMBL4161657 1 7.19
CHEMBL4159747 1 7.18
CHEMBL4173418 1 7.18
CHEMBL4170382 1 7.16
CHEMBL4174059 1 7.11
CHEMBL4172951 1 6.70
CHEMBL4162283 1 6.34
CHEMBL4176780 1 5.45
CHEMBL4168694 1 -
CHEMBL4168916 1 -
CHEMBL4172281 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4168598 Kd = 25.0 nM 7.60
CHEMBL4160774 Kd = 26.0 nM 7.58
CHEMBL4169566 Kd = 29.0 nM 7.54
CHEMBL4177418 Kd = 31.0 nM 7.51
CHEMBL4165495 Kd = 34.0 nM 7.47
CHEMBL4175693 Kd = 37.0 nM 7.43
CHEMBL4162694 Kd = 40.0 nM 7.40
CHEMBL4165074 Kd = 52.0 nM 7.28
CHEMBL4170618 Kd = 60.0 nM 7.22
CHEMBL4161657 Kd = 65.0 nM 7.19
CHEMBL4159747 Kd = 66.0 nM 7.18
CHEMBL4173418 Kd = 66.0 nM 7.18
CHEMBL4170382 Kd = 70.0 nM 7.16
CHEMBL4174059 Kd = 77.0 nM 7.11
CHEMBL4172951 Kd = 200.0 nM 6.70
CHEMBL4162283 Kd = 460.0 nM 6.34
CHEMBL4176780 Kd = 3520.0 nM 5.45
CHEMBL4168694 Kd > 100000.0 nM -
CHEMBL4168916 Kd > 50000.0 nM -
CHEMBL4172281 Kd > 10000.0 nM -