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Assay Detail

CHEMBL904863

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

Binding
Inhibition of human recombinant HSP90 in MCF7 cells assessed as Her2 degradation
31
Total Activities
31
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type MCF7
Confidence 5 — Multiple protein complex / RNA
Curated By Autocuration

Target

Heat shock protein HSP90 (CHEMBL2095165)
Type PROTEIN FAMILY
Organism Homo sapiens

Publication

Rationally designed high-affinity 2-amino-6-halopurine heat shock protein 90 inhibitors that exhibit potent antitumor activity.
Kasibhatla SR, Hong K, Biamonte MA, Busch DJ, Karjian PL, Sensintaffar JL, Kamal A, Lough RE, Brekken J, Lundgren K, Grecko R, Timony GA, Ran Y, Mansfield R, Fritz LC, Ulm E, Burrows FJ, Boehm MF.
J Med Chem (2007) 50 : 2767 -2778
PubMed 17488003 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 31 6.31 8.15

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL109480 TANESPIMYCIN 3.0 1 8.15
CHEMBL389164 1 8.05
CHEMBL229943 1 7.82
CHEMBL536072 1 7.70
CHEMBL229577 1 7.57
CHEMBL557165 1 7.52
CHEMBL229891 1 7.46
CHEMBL229576 1 7.38
CHEMBL388549 1 7.30
CHEMBL229691 1 7.26
CHEMBL229690 1 7.16
CHEMBL229839 1 7.10
CHEMBL388347 1 7.05
CHEMBL376166 1 7.05
CHEMBL388550 1 6.47
CHEMBL388821 1 6.16
CHEMBL228406 1 6.00
CHEMBL229838 1 5.82
CHEMBL388134 1 5.82
CHEMBL112953 1 5.77
CHEMBL228990 1 5.75
CHEMBL229639 1 5.70
CHEMBL229638 1 5.52
CHEMBL228407 1 5.24
CHEMBL228989 1 5.12
CHEMBL229692 1 4.77
CHEMBL390557 1 4.35
CHEMBL388822 1 4.30
CHEMBL375462 1 4.00
CHEMBL228991 1 4.00

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL109480 TANESPIMYCIN IC50 = 7.0 nM 8.15
CHEMBL389164 IC50 = 9.0 nM 8.05
CHEMBL229943 IC50 = 15.0 nM 7.82
CHEMBL536072 IC50 = 20.0 nM 7.70
CHEMBL229577 IC50 = 27.0 nM 7.57
CHEMBL557165 IC50 = 30.0 nM 7.52
CHEMBL229891 IC50 = 35.0 nM 7.46
CHEMBL229576 IC50 = 42.0 nM 7.38
CHEMBL388549 IC50 = 50.0 nM 7.30
CHEMBL229691 IC50 = 55.0 nM 7.26
CHEMBL229690 IC50 = 70.0 nM 7.16
CHEMBL229839 IC50 = 80.0 nM 7.10
CHEMBL388347 IC50 = 90.0 nM 7.05
CHEMBL376166 IC50 = 90.0 nM 7.05
CHEMBL388550 IC50 = 340.0 nM 6.47
CHEMBL388821 IC50 = 700.0 nM 6.16
CHEMBL228406 IC50 = 1000.0 nM 6.00
CHEMBL229838 IC50 = 1500.0 nM 5.82
CHEMBL388134 IC50 = 1500.0 nM 5.82
CHEMBL112953 IC50 = 1700.0 nM 5.77
CHEMBL228990 IC50 = 1800.0 nM 5.75
CHEMBL229639 IC50 = 2000.0 nM 5.70
CHEMBL229638 IC50 = 3000.0 nM 5.52
CHEMBL228407 IC50 = 5800.0 nM 5.24
CHEMBL228989 IC50 = 7500.0 nM 5.12
CHEMBL229692 IC50 = 17000.0 nM 4.77
CHEMBL390557 IC50 = 45000.0 nM 4.35
CHEMBL388822 IC50 = 50000.0 nM 4.30
CHEMBL375462 IC50 = 100000.0 nM 4.00
CHEMBL228991 IC50 = 100000.0 nM 4.00
CHEMBL229797 IC50 > 10000.0 nM -