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Assay Detail

CHEMBL863709

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Binding
Inhibition of rat cathepsin K
13
Total Activities
13
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Rattus norvegicus
Confidence 9 — Direct single protein target
Curated By Expert

Target

Cathepsin K (CHEMBL3034)
Type SINGLE PROTEIN
Organism Rattus norvegicus

Publication

Structure activity relationships of 5-, 6-, and 7-methyl-substituted azepan-3-one cathepsin K inhibitors.
Yamashita DS, Marquis RW, Xie R, Nidamarthy SD, Oh HJ, Jeong JU, Erhard KF, Ward KW, Roethke TJ, Smith BR, Cheng HY, Geng X, Lin F, Offen PH, Wang B, Nevins N, Head MS, Haltiwanger RC, Narducci Sarjeant AA, Liable-Sands LM, Zhao B, Smith WW, Janson CA, Gao E, Tomaszek T, McQueney M, James IE, Gress CJ, Zembryki DL, Lark MW, Veber DF.
J Med Chem (2006) 49 : 1597 -1612
PubMed 16509577 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 9 6.75 8.10
Ki app 4 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL203665 RELACATIB 2.0 1 8.10
CHEMBL286364 1 7.22
CHEMBL205172 1 7.14
CHEMBL203224 1 6.37
CHEMBL440574 1 6.18
CHEMBL377713 1 6.17
CHEMBL202991 1 6.10
CHEMBL203845 1 -
CHEMBL205068 1 -
CHEMBL203556 1 -
CHEMBL204169 1 -
CHEMBL438435 1 -
CHEMBL202668 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL203665 RELACATIB Ki = 8.0 nM 8.10
CHEMBL286364 Ki = 60.0 nM 7.22
CHEMBL205172 Ki = 73.0 nM 7.14
CHEMBL203224 Ki = 430.0 nM 6.37
CHEMBL440574 Ki = 660.0 nM 6.18
CHEMBL377713 Ki = 680.0 nM 6.17
CHEMBL202991 Ki = 790.0 nM 6.10
CHEMBL203845 Ki app - -
CHEMBL205068 Ki > 1000.0 nM -
CHEMBL203556 Ki app - -
CHEMBL204169 Ki app - -
CHEMBL438435 Ki > 1000.0 nM -
CHEMBL202668 Ki app - -