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Assay Detail

CHEMBL658345

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

Binding
Equilibrium dissociation constant determined using fluorescence based competitive binding assay towards Cathepsin S
27
Total Activities
27
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Cathepsin S (CHEMBL2954)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Design and synthesis of dipeptide nitriles as reversible and potent Cathepsin S inhibitors.
Ward YD, Thomson DS, Frye LL, Cywin CL, Morwick T, Emmanuel MJ, Zindell R, McNeil D, Bekkali Y, Girardot M, Hrapchak M, DeTuri M, Crane K, White D, Pav S, Wang Y, Hao MH, Grygon CA, Labadia ME, Freeman DM, Davidson W, Hopkins JL, Brown ML, Spero DM.
J Med Chem (2002) 45 : 5471 -5482
PubMed 12459015 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 27 8.82 10.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL155560 1 10.00
CHEMBL356442 1 10.00
CHEMBL153813 1 9.52
CHEMBL149523 1 9.52
CHEMBL152940 1 9.52
CHEMBL153018 1 9.40
CHEMBL150253 1 9.40
CHEMBL347111 1 9.40
CHEMBL356167 1 9.30
CHEMBL153783 1 9.22
CHEMBL153248 1 9.22
CHEMBL356155 1 9.15
CHEMBL153239 1 9.10
CHEMBL348679 1 9.05
CHEMBL435440 1 9.00
CHEMBL151642 1 8.70
CHEMBL346448 1 8.52
CHEMBL347745 1 8.40
CHEMBL150358 1 8.40
CHEMBL345502 1 8.30
CHEMBL153319 1 8.15
CHEMBL153678 1 8.15
CHEMBL150574 1 8.05
CHEMBL358829 1 7.55
CHEMBL356669 1 7.22
CHEMBL154808 1 7.20
CHEMBL358695 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL155560 Kd = 0.1 nM 10.00
CHEMBL356442 Kd = 0.1 nM 10.00
CHEMBL153813 Kd = 0.3 nM 9.52
CHEMBL149523 Kd = 0.3 nM 9.52
CHEMBL152940 Kd = 0.3 nM 9.52
CHEMBL153018 Kd = 0.4 nM 9.40
CHEMBL150253 Kd = 0.4 nM 9.40
CHEMBL347111 Kd = 0.4 nM 9.40
CHEMBL356167 Kd = 0.5 nM 9.30
CHEMBL153783 Kd = 0.6 nM 9.22
CHEMBL153248 Kd = 0.6 nM 9.22
CHEMBL356155 Kd = 0.7 nM 9.15
CHEMBL153239 Kd = 0.8 nM 9.10
CHEMBL348679 Kd = 0.9 nM 9.05
CHEMBL435440 Kd = 1.0 nM 9.00
CHEMBL151642 Kd = 2.0 nM 8.70
CHEMBL346448 Kd = 3.0 nM 8.52
CHEMBL347745 Kd = 4.0 nM 8.40
CHEMBL150358 Kd = 4.0 nM 8.40
CHEMBL345502 Kd = 5.0 nM 8.30
CHEMBL153319 Kd = 7.0 nM 8.15
CHEMBL153678 Kd = 7.0 nM 8.15
CHEMBL150574 Kd = 9.0 nM 8.05
CHEMBL358829 Kd = 28.0 nM 7.55
CHEMBL356669 Kd = 60.0 nM 7.22
CHEMBL154808 Kd = 63.0 nM 7.20
CHEMBL358695 Kd > 20000.0 nM -