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PubMed code 15780613

Compile data set for download or QSAR
Found 28 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cathepsin K


(Homo sapiens (Human))
BDBM50163831
PNG
((2S)-1-cyclohexylpropan-2-yl 1-cyanoazetidine-2-ca...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCN1C#N
Show InChI InChI=1S/C14H22N2O2/c1-11(9-12-5-3-2-4-6-12)18-14(17)13-7-8-16(13)10-15/h11-13H,2-9H2,1H3/t11-,13?/m0/s1
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n/an/a 0.0480n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50148310
PNG
(((S)-1-Formyl-pentyl)-carbamic acid (S)-1-benzyl-p...)
Show SMILES CCCC[C@H](NC(=O)O[C@@H](CC)Cc1ccccc1)C=O
Show InChI InChI=1S/C17H25NO3/c1-3-5-11-15(13-19)18-17(20)21-16(4-2)12-14-9-7-6-8-10-14/h6-10,13,15-16H,3-5,11-12H2,1-2H3,(H,18,20)/t15-,16-/m0/s1
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n/an/a 0.130n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Procathepsin L


(Homo sapiens (Human))
BDBM50163831
PNG
((2S)-1-cyclohexylpropan-2-yl 1-cyanoazetidine-2-ca...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCN1C#N
Show InChI InChI=1S/C14H22N2O2/c1-11(9-12-5-3-2-4-6-12)18-14(17)13-7-8-16(13)10-15/h11-13H,2-9H2,1H3/t11-,13?/m0/s1
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n/an/a 0.710n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin L using 5 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163832
PNG
((1S)-2-cyclohexyl-1-methylethyl (2S)-1-cyanopyrrol...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCCN1C#N
Show InChI InChI=1S/C15H24N2O2/c1-12(10-13-6-3-2-4-7-13)19-15(18)14-8-5-9-17(14)11-16/h12-14H,2-10H2,1H3/t12-,14?/m0/s1
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n/an/a 1.80n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))
BDBM50163831
PNG
((2S)-1-cyclohexylpropan-2-yl 1-cyanoazetidine-2-ca...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCN1C#N
Show InChI InChI=1S/C14H22N2O2/c1-11(9-12-5-3-2-4-6-12)18-14(17)13-7-8-16(13)10-15/h11-13H,2-9H2,1H3/t11-,13?/m0/s1
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n/an/a 2.40n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin B using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50148291
PNG
(((S)-1-Formyl-pentyl)-carbamic acid (S)-2-cyclohex...)
Show SMILES CCCC[C@H](NC(=O)O[C@@H](C)CC1CCCCC1)C=O
Show InChI InChI=1S/C16H29NO3/c1-3-4-10-15(12-18)17-16(19)20-13(2)11-14-8-6-5-7-9-14/h12-15H,3-11H2,1-2H3,(H,17,19)/t13-,15-/m0/s1
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n/an/a 2.70n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163841
PNG
((1-Cyano-pyrrolidin-3-yl)-carbamic acid (S)-1-cycl...)
Show SMILES CC[C@@H](CC1CCCCC1)OC(=O)NC1CCN(C1)C#N
Show InChI InChI=1S/C16H27N3O2/c1-2-15(10-13-6-4-3-5-7-13)21-16(20)18-14-8-9-19(11-14)12-17/h13-15H,2-11H2,1H3,(H,18,20)/t14?,15-/m0/s1
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n/an/a 8.90n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163838
PNG
((1-Cyano-pyrrolidin-3-yl)-carbamic acid (S)-2-cycl...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)N[C@H]1CCN(C1)C#N
Show InChI InChI=1S/C15H25N3O2/c1-12(9-13-5-3-2-4-6-13)20-15(19)17-14-7-8-18(10-14)11-16/h12-14H,2-10H2,1H3,(H,17,19)/t12-,14-/m0/s1
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n/an/a 12n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163842
PNG
(CHEMBL183658 | [1-((S)-1-Cyano-pyrrolidin-3-ylcarb...)
Show SMILES CC(C)C[C@H](NC(=O)OCC1CCCCC1)C(=O)NC1CCN(C1)C#N
Show InChI InChI=1S/C19H32N4O3/c1-14(2)10-17(18(24)21-16-8-9-23(11-16)13-20)22-19(25)26-12-15-6-4-3-5-7-15/h14-17H,3-12H2,1-2H3,(H,21,24)(H,22,25)/t16?,17-/m0/s1
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n/an/a 19n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Pro-cathepsin H


(Homo sapiens (Human))
BDBM50163831
PNG
((2S)-1-cyclohexylpropan-2-yl 1-cyanoazetidine-2-ca...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCN1C#N
Show InChI InChI=1S/C14H22N2O2/c1-11(9-12-5-3-2-4-6-12)18-14(17)13-7-8-16(13)10-15/h11-13H,2-9H2,1H3/t11-,13?/m0/s1
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n/an/a 40n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin H using 50 uM L-Arg-beta-naphthalamide


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163836
PNG
(((R)-1-Formyl-pentyl)-carbamic acid tert-butyl est...)
Show SMILES CCCC[C@@H](NC(=O)OC(C)(C)C)C=O
Show InChI InChI=1S/C11H21NO3/c1-5-6-7-9(8-13)12-10(14)15-11(2,3)4/h8-9H,5-7H2,1-4H3,(H,12,14)/t9-/m1/s1
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n/an/a 51n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163834
PNG
((S)-1-Cyano-pyrrolidine-2-carboxylic acid tert-but...)
Show SMILES CC(C)(C)OC(=O)[C@@H]1CCCN1C#N
Show InChI InChI=1S/C10H16N2O2/c1-10(2,3)14-9(13)8-5-4-6-12(8)7-11/h8H,4-6H2,1-3H3/t8-/m0/s1
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n/an/a 60n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Procathepsin L


(Homo sapiens (Human))
BDBM50163838
PNG
((1-Cyano-pyrrolidin-3-yl)-carbamic acid (S)-2-cycl...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)N[C@H]1CCN(C1)C#N
Show InChI InChI=1S/C15H25N3O2/c1-12(9-13-5-3-2-4-6-13)20-15(19)17-14-7-8-18(10-14)11-16/h12-14H,2-10H2,1H3,(H,17,19)/t12-,14-/m0/s1
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n/an/a 81n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin L using 5 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50024322
PNG
(CHEMBL2096777)
Show SMILES CC(C)(C)OC(=O)N[C@H]1CCN(C1)C#N |r|
Show InChI InChI=1S/C10H17N3O2/c1-10(2,3)15-9(14)12-8-4-5-13(6-8)7-11/h8H,4-6H2,1-3H3,(H,12,14)/t8-/m0/s1
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n/an/a 81n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Procathepsin L


(Homo sapiens (Human))
BDBM50163832
PNG
((1S)-2-cyclohexyl-1-methylethyl (2S)-1-cyanopyrrol...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCCN1C#N
Show InChI InChI=1S/C15H24N2O2/c1-12(10-13-6-3-2-4-7-13)19-15(18)14-8-5-9-17(14)11-16/h12-14H,2-10H2,1H3/t12-,14?/m0/s1
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n/an/a 130n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin L using 5 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50024323
PNG
(CHEMBL2096698)
Show SMILES CC(C)(C)OC(=O)N[C@@H]1CCN(C1)C#N |r|
Show InChI InChI=1S/C10H17N3O2/c1-10(2,3)15-9(14)12-8-4-5-13(6-8)7-11/h8H,4-6H2,1-3H3,(H,12,14)/t8-/m1/s1
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n/an/a 200n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163845
PNG
(3-Cyanoamino-pyrrolidine-1-carboxylic acid (S)-1-c...)
Show SMILES CC[C@@H](CC1CCCCC1)OC(=O)N1CCC(C1)NC#N
Show InChI InChI=1S/C16H27N3O2/c1-2-15(10-13-6-4-3-5-7-13)21-16(20)19-9-8-14(11-19)18-12-17/h13-15,18H,2-11H2,1H3/t14?,15-/m0/s1
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n/an/a 200n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163839
PNG
((R)-1-Cyano-pyrrolidine-2-carboxylic acid tert-but...)
Show SMILES CC(C)(C)OC(=O)[C@H]1CCCN1C#N
Show InChI InChI=1S/C10H16N2O2/c1-10(2,3)14-9(13)8-5-4-6-12(8)7-11/h8H,4-6H2,1-3H3/t8-/m1/s1
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n/an/a 300n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))
BDBM50163832
PNG
((1S)-2-cyclohexyl-1-methylethyl (2S)-1-cyanopyrrol...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCCN1C#N
Show InChI InChI=1S/C15H24N2O2/c1-12(10-13-6-3-2-4-7-13)19-15(18)14-8-5-9-17(14)11-16/h12-14H,2-10H2,1H3/t12-,14?/m0/s1
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n/an/a 310n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin B using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163837
PNG
(2-Cyano-pyrazolidine-1-carboxylic acid tert-butyl ...)
Show SMILES CC(C)(C)OC(=O)N1CCCN1C#N
Show InChI InChI=1S/C9H15N3O2/c1-9(2,3)14-8(13)12-6-4-5-11(12)7-10/h4-6H2,1-3H3
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n/an/a 380n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163844
PNG
((3S,4R)-1-Cyano-4-(3-cyclopentyloxy-4-methoxy-phen...)
Show SMILES COC(=O)[C@@H]1CN(C[C@H]1c1ccc(OC)c(OC2CCCC2)c1)C#N
Show InChI InChI=1S/C19H24N2O4/c1-23-17-8-7-13(9-18(17)25-14-5-3-4-6-14)15-10-21(12-20)11-16(15)19(22)24-2/h7-9,14-16H,3-6,10-11H2,1-2H3/t15-,16+/m0/s1
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n/an/a 430n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Pro-cathepsin H


(Homo sapiens (Human))
BDBM50163832
PNG
((1S)-2-cyclohexyl-1-methylethyl (2S)-1-cyanopyrrol...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCCN1C#N
Show InChI InChI=1S/C15H24N2O2/c1-12(10-13-6-3-2-4-7-13)19-15(18)14-8-5-9-17(14)11-16/h12-14H,2-10H2,1H3/t12-,14?/m0/s1
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n/an/a 580n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin H using 50 uM L-Arg-beta-naphthalamide


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))
BDBM50163838
PNG
((1-Cyano-pyrrolidin-3-yl)-carbamic acid (S)-2-cycl...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)N[C@H]1CCN(C1)C#N
Show InChI InChI=1S/C15H25N3O2/c1-12(9-13-5-3-2-4-6-13)20-15(19)17-14-7-8-18(10-14)11-16/h12-14H,2-10H2,1H3,(H,17,19)/t12-,14-/m0/s1
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n/an/a 680n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin B using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163843
PNG
((R)-1-Cyano-pyrrolidine-2-carboxylic acid tert-but...)
Show SMILES CN(C(=O)[C@H]1CCCN1C#N)C(C)(C)C
Show InChI InChI=1S/C11H19N3O/c1-11(2,3)13(4)10(15)9-6-5-7-14(9)8-12/h9H,5-7H2,1-4H3/t9-/m1/s1
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n/an/a>1.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163840
PNG
((S)-1-Cyano-piperidine-2-carboxylic acid tert-buty...)
Show SMILES CC(C)(C)OC(=O)[C@@H]1CCCCN1C#N
Show InChI InChI=1S/C11H18N2O2/c1-11(2,3)15-10(14)9-6-4-5-7-13(9)8-12/h9H,4-7H2,1-3H3/t9-/m0/s1
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n/an/a>1.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50095495
PNG
(CHEMBL262697 | Pyrrolidine-1-carbonitrile)
Show SMILES N#CN1CCCC1
Show InChI InChI=1S/C5H8N2/c6-5-7-3-1-2-4-7/h1-4H2
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n/an/a 2.10E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50163833
PNG
((R)-1-Cyano-pyrrolidine-2-carboxylic acid tert-but...)
Show SMILES CC(C)(C)NC(=O)[C@H]1CCCN1C#N
Show InChI InChI=1S/C10H17N3O/c1-10(2,3)12-9(14)8-5-4-6-13(8)7-11/h8H,4-6H2,1-3H3,(H,12,14)/t8-/m1/s1
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n/an/a 8.10E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
Pro-cathepsin H


(Homo sapiens (Human))
BDBM50163838
PNG
((1-Cyano-pyrrolidin-3-yl)-carbamic acid (S)-2-cycl...)
Show SMILES C[C@@H](CC1CCCCC1)OC(=O)N[C@H]1CCN(C1)C#N
Show InChI InChI=1S/C15H25N3O2/c1-12(9-13-5-3-2-4-6-13)20-15(19)17-14-7-8-18(10-14)11-16/h12-14H,2-10H2,1H3,(H,17,19)/t12-,14-/m0/s1
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n/an/a 8.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cathepsin H using 50 uM L-Arg-beta-naphthalamide


Bioorg Med Chem Lett 15: 1815-9 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.033
BindingDB Entry DOI: 10.7270/Q2DR2V1G
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%