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Assay Detail

CHEMBL811969

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

Binding
In vitro inhibitory constant against human thrombin (FIIa).
35
Total Activities
35
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Expert

Target

Prothrombin (CHEMBL204)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Non-covalent thrombin inhibitors featuring P(3)-heterocycles with P(1)-monocyclic arginine surrogates.
Reiner JE, Siev DV, Araldi GL, Cui JJ, Ho JZ, Reddy KM, Mamedova L, Vu PH, Lee KS, Minami NK, Gibson TS, Anderson SM, Bradbury AE, Nolan TG, Semple JE.
Bioorg Med Chem Lett (2002) 12 : 1203 -1208
PubMed 11934589 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 35 8.12 10.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL19831 1 10.00
CHEMBL19666 1 10.00
CHEMBL277695 1 9.92
CHEMBL431292 CVS-2359 1 9.85
CHEMBL19731 1 9.43
CHEMBL19599 CVS-2139 1 9.25
CHEMBL19359 1 9.24
CHEMBL11157 L-374087 1 9.17
CHEMBL19811 1 9.00
CHEMBL19080 L-375378 1 9.00
CHEMBL274968 1 8.96
CHEMBL416912 1 8.80
CHEMBL417635 1 8.72
CHEMBL19548 1 8.49
CHEMBL19619 1 8.44
CHEMBL19453 1 8.28
CHEMBL19689 1 8.26
CHEMBL19740 1 8.23
CHEMBL19798 1 8.23
CHEMBL279199 1 8.22
CHEMBL282028 1 8.01
CHEMBL417457 1 7.88
CHEMBL283555 1 7.68
CHEMBL19644 1 7.51
CHEMBL283945 1 7.07
CHEMBL19700 1 6.99
CHEMBL19037 1 6.87
CHEMBL19527 1 6.85
CHEMBL19241 1 6.80
CHEMBL19071 1 6.71

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL19831 Ki = 0.1 nM 10.00
CHEMBL19666 Ki = 0.1 nM 10.00
CHEMBL277695 Ki = 0.12 nM 9.92
CHEMBL431292 CVS-2359 Ki = 0.14 nM 9.85
CHEMBL19731 Ki = 0.37 nM 9.43
CHEMBL19599 CVS-2139 Ki = 0.56 nM 9.25
CHEMBL19359 Ki = 0.57 nM 9.24
CHEMBL11157 L-374087 Ki = 0.68 nM 9.17
CHEMBL19811 Ki = 1.0 nM 9.00
CHEMBL19080 L-375378 Ki = 1.0 nM 9.00
CHEMBL274968 Ki = 1.1 nM 8.96
CHEMBL416912 Ki = 1.6 nM 8.80
CHEMBL417635 Ki = 1.9 nM 8.72
CHEMBL19548 Ki = 3.2 nM 8.49
CHEMBL19619 Ki = 3.6 nM 8.44
CHEMBL19453 Ki = 5.3 nM 8.28
CHEMBL19689 Ki = 5.5 nM 8.26
CHEMBL19740 Ki = 5.9 nM 8.23
CHEMBL19798 Ki = 5.9 nM 8.23
CHEMBL279199 Ki = 6.0 nM 8.22
CHEMBL282028 Ki = 9.8 nM 8.01
CHEMBL417457 Ki = 13.2 nM 7.88
CHEMBL283555 Ki = 20.8 nM 7.68
CHEMBL19644 Ki = 30.8 nM 7.51
CHEMBL283945 Ki = 85.2 nM 7.07
CHEMBL19700 Ki = 103.2 nM 6.99
CHEMBL19037 Ki = 136.0 nM 6.87
CHEMBL19527 Ki = 140.8 nM 6.85
CHEMBL19241 Ki = 157.9 nM 6.80
CHEMBL19071 Ki = 196.8 nM 6.71
CHEMBL18873 Ki = 276.2 nM 6.56
CHEMBL19728 Ki = 281.0 nM 6.55
CHEMBL18759 Ki = 323.8 nM 6.49
CHEMBL19438 Ki = 357.1 nM 6.45
CHEMBL19767 Ki = 461.9 nM 6.33