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Assay Detail

CHEMBL4668615

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

Binding
Binding affinity to N-terminal GST-fused human PTP1B (1 to 288 residues) expressed in Escherichia coli BL21(DE3) by HSQC NMR analysis
4
Total Activities
4
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

Tyrosine-protein phosphatase non-receptor type 1 (CHEMBL335)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Fragment Linking Strategies for Structure-Based Drug Design.
Bancet A,Raingeval C,Lomberget T,Le Borgne M,Guichou JF,Krimm I
J Med Chem (2020) 63 : 11420 -11435
PubMed 32539387 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 4 3.34 4.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL65459 1 4.00
CHEMBL115406 1 3.10
CHEMBL1169 AMINOSALICYLIC ACID 4.0 1 2.92
CHEMBL1160559 QUINALDIC ACID 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL65459 Kd = 100000.0 nM 4.00
CHEMBL115406 Kd = 800000.0 nM 3.10
CHEMBL1169 AMINOSALICYLIC ACID Kd = 1200000.0 nM 2.92
CHEMBL1160559 QUINALDIC ACID Kd > 1000000.0 nM -