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Assay Detail

CHEMBL4432509

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

Binding
Inhibition of 6x-His tagged human recombinant full length Hsp90alpha ATPase preincubated for 0.5 hrs followed by ATP addition measured after 30 mins by HTRF assay
24
Total Activities
24
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-alpha (CHEMBL3880)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-activity relationship of Garcinia xanthones analogues: Potent Hsp90 inhibitors with cytotoxicity and antiangiogenesis activity.
Xu X, Wu Y, Hu M, Li X, Gu C, You Q, Zhang X.
Bioorg Med Chem (2016) 24 : 4626 -4635
PubMed 27527413 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 24 4.66 6.04

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL383824 ALVESPIMYCIN 2.0 1 6.04
CHEMBL4593194 1 5.43
CHEMBL4564026 1 5.21
CHEMBL4439457 1 5.07
CHEMBL4515544 1 4.87
CHEMBL4572319 1 4.84
CHEMBL4450787 1 4.82
CHEMBL1762708 1 4.81
CHEMBL555017 GAMBOGIC ACID 1 4.66
CHEMBL4452643 1 4.65
CHEMBL4575582 1 4.64
CHEMBL1762712 1 4.62
CHEMBL4515685 1 4.56
CHEMBL4552658 1 4.55
CHEMBL4437572 1 4.45
CHEMBL4580862 1 4.44
CHEMBL4472575 1 4.37
CHEMBL4578413 1 4.37
CHEMBL4441422 1 4.28
CHEMBL4446842 1 4.26
CHEMBL4581935 1 4.17
CHEMBL4538037 1 4.12
CHEMBL4560082 1 4.05
CHEMBL4443399 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL383824 ALVESPIMYCIN IC50 = 919.0 nM 6.04
CHEMBL4593194 IC50 = 3680.0 nM 5.43
CHEMBL4564026 IC50 = 6200.0 nM 5.21
CHEMBL4439457 IC50 = 8520.0 nM 5.07
CHEMBL4515544 IC50 = 13620.0 nM 4.87
CHEMBL4572319 IC50 = 14330.0 nM 4.84
CHEMBL4450787 IC50 = 15290.0 nM 4.82
CHEMBL1762708 IC50 = 15530.0 nM 4.81
CHEMBL555017 GAMBOGIC ACID IC50 = 21980.0 nM 4.66
CHEMBL4452643 IC50 = 22400.0 nM 4.65
CHEMBL4575582 IC50 = 22630.0 nM 4.64
CHEMBL1762712 IC50 = 23930.0 nM 4.62
CHEMBL4515685 IC50 = 27340.0 nM 4.56
CHEMBL4552658 IC50 = 28030.0 nM 4.55
CHEMBL4437572 IC50 = 35240.0 nM 4.45
CHEMBL4580862 IC50 = 36620.0 nM 4.44
CHEMBL4472575 IC50 = 42980.0 nM 4.37
CHEMBL4578413 IC50 = 42410.0 nM 4.37
CHEMBL4441422 IC50 = 52670.0 nM 4.28
CHEMBL4446842 IC50 = 54680.0 nM 4.26
CHEMBL4581935 IC50 = 67060.0 nM 4.17
CHEMBL4538037 IC50 = 76810.0 nM 4.12
CHEMBL4560082 IC50 = 89830.0 nM 4.05
CHEMBL4443399 IC50 > 100000.0 nM -