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Assay Detail

CHEMBL3399897

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

Binding
Inhibition of human trypsin at 25 degC
20
Total Activities
18
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Trypsin (CHEMBL2095204)
Type PROTEIN FAMILY
Organism Homo sapiens

Publication

Structure-based design of inhibitors of coagulation factor XIa with novel P1 moieties.
Pinto DJ, Smallheer JM, Corte JR, Austin EJ, Wang C, Fang T, Smith LM, Rossi KA, Rendina AR, Bozarth JM, Zhang G, Wei A, Ramamurthy V, Sheriff S, Myers JE, Morin PE, Luettgen JM, Seiffert DA, Quan ML, Wexler RR.
Bioorg Med Chem Lett (2015) 25 : 1635 -1642
PubMed 25728130 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 20 6.47 7.64

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3398612 1 7.64
CHEMBL3398615 1 7.24
CHEMBL3398614 1 7.23
CHEMBL3398616 3 6.44
CHEMBL3398617 1 6.42
CHEMBL3398613 1 5.98
CHEMBL3398618 1 5.85
CHEMBL3398644 1 -
CHEMBL3398642 1 -
CHEMBL3398620 1 -
CHEMBL3398621 1 -
CHEMBL3398622 1 -
CHEMBL3398623 1 -
CHEMBL3398624 1 -
CHEMBL3398625 1 -
CHEMBL3398626 1 -
CHEMBL3398627 1 -
CHEMBL3398619 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3398612 Ki = 23.0 nM 7.64
CHEMBL3398615 Ki = 58.0 nM 7.24
CHEMBL3398614 Ki = 59.0 nM 7.23
CHEMBL3398616 Ki = 360.0 nM 6.44
CHEMBL3398617 Ki = 380.0 nM 6.42
CHEMBL3398613 Ki = 1040.0 nM 5.98
CHEMBL3398618 Ki = 1400.0 nM 5.85
CHEMBL3398616 Ki = 1430.0 nM 5.84
CHEMBL3398616 Ki = 2800.0 nM 5.55
CHEMBL3398644 Ki > 6200.0 nM -
CHEMBL3398619 Ki > 5000.0 nM -
CHEMBL3398620 Ki > 5000.0 nM -
CHEMBL3398621 Ki > 6000.0 nM -
CHEMBL3398622 Ki > 5000.0 nM -
CHEMBL3398623 Ki > 5000.0 nM -
CHEMBL3398624 Ki > 5000.0 nM -
CHEMBL3398625 Ki > 6000.0 nM -
CHEMBL3398626 Ki > 6000.0 nM -
CHEMBL3398642 Ki > 6200.0 nM -
CHEMBL3398627 Ki > 5000.0 nM -