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Assay Detail

CHEMBL4713577

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Binding
Binding affinity to human thrombin
2
Total Activities
2
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

Prothrombin (CHEMBL204)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

How a Fragment Draws Attention to Selectivity Discriminating Features between the Related Proteases Trypsin and Thrombin.
Sandner A,Ngo K,Schiebel J,Pizarroso AIM,Schmidt L,Wenzel B,Steinmetzer T,Ostermann A,Heine A,Klebe G
J Med Chem (2021) 64 : 1611 -1625
PubMed 33471524 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 2 7.75 9.26

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL312145 1 9.26
CHEMBL321130 1 6.23

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL312145 Kd = 0.55 nM 9.26
CHEMBL321130 Kd = 590.0 nM 6.23