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Assay Detail

CHEMBL813633

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

Binding
In vitro for inhibition of human thrombin
32
Total Activities
32
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

Discovery of 1-(2-aminomethylphenyl)-3-trifluoromethyl-N- [3-fluoro-2'-(aminosulfonyl)[1,1'-biphenyl)]-4-yl]-1H-pyrazole-5-carboxyamide (DPC602), a potent, selective, and orally bioavailable factor Xa inhibitor(1).
Pruitt JR, Pinto DJ, Galemmo RA, Alexander RS, Rossi KA, Wells BL, Drummond S, Bostrom LL, Burdick D, Bruckner R, Chen H, Smallwood A, Wong PC, Wright MR, Bai S, Luettgen JM, Knabb RM, Lam PY, Wexler RR.
J Med Chem (2003) 46 : 5298 -5315
PubMed 14640539 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 32 5.40 6.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL37251 1 6.52
CHEMBL348441 1 5.85
CHEMBL146910 1 5.82
CHEMBL151939 1 5.44
CHEMBL148944 1 5.39
CHEMBL559015 1 5.22
CHEMBL134736 1 5.22
CHEMBL148718 1 5.19
CHEMBL151201 1 5.04
CHEMBL151627 1 4.85
CHEMBL151750 1 4.82
CHEMBL358604 1 -
CHEMBL355992 1 -
CHEMBL434659 1 -
CHEMBL151522 1 -
CHEMBL139121 1 -
CHEMBL345731 1 -
CHEMBL147171 1 -
CHEMBL151122 1 -
CHEMBL146982 1 -
CHEMBL149583 1 -
CHEMBL358488 1 -
CHEMBL356261 1 -
CHEMBL151629 1 -
CHEMBL146793 1 -
CHEMBL139788 1 -
CHEMBL357739 1 -
CHEMBL423759 1 -
CHEMBL343472 1 -
CHEMBL147132 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL37251 Ki = 300.0 nM 6.52
CHEMBL348441 Ki = 1400.0 nM 5.85
CHEMBL146910 Ki = 1500.0 nM 5.82
CHEMBL151939 Ki = 3600.0 nM 5.44
CHEMBL148944 Ki = 4100.0 nM 5.39
CHEMBL559015 Ki = 6000.0 nM 5.22
CHEMBL134736 Ki = 6000.0 nM 5.22
CHEMBL148718 Ki = 6500.0 nM 5.19
CHEMBL151201 Ki = 9100.0 nM 5.04
CHEMBL151627 Ki = 14000.0 nM 4.85
CHEMBL151750 Ki = 15000.0 nM 4.82
CHEMBL359449 Ki > 21000.0 nM -
CHEMBL149260 Ki > 21000.0 nM -
CHEMBL358604 Ki > 13000.0 nM -
CHEMBL355992 Ki > 21000.0 nM -
CHEMBL434659 Ki > 21000.0 nM -
CHEMBL151522 Ki > 21000.0 nM -
CHEMBL139121 Ki > 21000.0 nM -
CHEMBL345731 Ki > 21000.0 nM -
CHEMBL147171 Ki > 21000.0 nM -
CHEMBL151122 Ki > 21000.0 nM -
CHEMBL146982 Ki > 21000.0 nM -
CHEMBL149583 Ki > 21000.0 nM -
CHEMBL358488 Ki > 21000.0 nM -
CHEMBL356261 Ki > 21000.0 nM -
CHEMBL151629 Ki > 21000.0 nM -
CHEMBL146793 Ki > 21000.0 nM -
CHEMBL139788 Ki > 21000.0 nM -
CHEMBL357739 Ki > 21000.0 nM -
CHEMBL423759 Ki > 21000.0 nM -
CHEMBL343472 Ki > 21000.0 nM -
CHEMBL147132 Ki > 21000.0 nM -