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9 similar compounds to monomer 50169483

Compile data set for download or QSAR
Wt: 520.6
BDBM50169481
Wt: 539.5
BDBM50169484
Wt: 548.6
BDBM50169486
Wt: 545.6
BDBM50169487
Wt: 602.6
BDBM50169492
Wt: 534.6
BDBM50169494
Wt: 534.6
BDBM50169496
Wt: 545.6
BDBM50415755
Wt: 520.6
BDBM50415759

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 37 hits for monomerid = 50169481,50169484,50169486,50169487,50169492,50169494,50169496,50415755,50415759   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cathepsin L1


(Homo sapiens (Human))
BDBM50169481
PNG
(CHEMBL189604 | [(S)-1-(1-Phenyl-ethylaminooxalyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C29H36N4O5/c1-5-6-17-23(26(34)27(35)30-20(4)21-13-9-7-10-14-21)31-29(36)37-24(19(2)3)18-25-32-33-28(38-25)22-15-11-8-12-16-22/h7-16,19-20,23-24H,5-6,17-18H2,1-4H3,(H,30,35)(H,31,36)/t20-,23+,24-/m1/s1
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n/an/a 1.70E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 5 lM Cbz-Phe-Arg-AMC bindign to human cathepsin L activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50415759
PNG
(CHEMBL1087763)
Show SMILES CCCC[C@H](NC(=O)O[C@@H](Cc1nnc(o1)-c1ccccc1)C(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1/C29H36N4O5/c1-5-6-17-23(26(34)27(35)30-20(4)21-13-9-7-10-14-21)31-29(36)37-24(19(2)3)18-25-32-33-28(38-25)22-15-11-8-12-16-22/h7-16,19-20,23-24H,5-6,17-18H2,1-4H3,(H,30,35)(H,31,36)/t20-,23+,24+/s2
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n/an/a 0.832n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin K


Eur J Med Chem 45: 667-81 (2010)


Article DOI: 10.1016/j.ejmech.2009.11.010
BindingDB Entry DOI: 10.7270/Q29C6ZP1
More data for this
Ligand-Target Pair
Cathepsin (B and K)


(Homo sapiens (Human))
BDBM50169486
PNG
(CHEMBL188563 | [(S)-1-(1-Phenyl-ethylaminooxalyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)CC)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H40N4O5/c1-6-8-19-24(27(36)28(37)32-21(3)22-15-11-9-12-16-22)33-30(38)39-25(31(4,5)7-2)20-26-34-35-29(40-26)23-17-13-10-14-18-23/h9-18,21,24-25H,6-8,19-20H2,1-5H3,(H,32,37)(H,33,38)/t21-,24+,25-/m1/s1
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n/an/a 5.60E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin B activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))
BDBM50169486
PNG
(CHEMBL188563 | [(S)-1-(1-Phenyl-ethylaminooxalyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)CC)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H40N4O5/c1-6-8-19-24(27(36)28(37)32-21(3)22-15-11-9-12-16-22)33-30(38)39-25(31(4,5)7-2)20-26-34-35-29(40-26)23-17-13-10-14-18-23/h9-18,21,24-25H,6-8,19-20H2,1-5H3,(H,32,37)(H,33,38)/t21-,24+,25-/m1/s1
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n/an/a 720n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Val-Val-Arg-AMC binding to human cathepsin S in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin L1


(Homo sapiens (Human))
BDBM50169487
PNG
(CHEMBL426617 | [(S)-1-((S)-2-Oxo-piperidin-3-ylami...)
Show SMILES CCCC[C@H](NC(=O)OC(Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)N[C@H]1CCCNC1=O
Show InChI InChI=1S/C27H36FN5O6/c1-5-6-8-18(22(34)24(36)30-19-9-7-14-29-23(19)35)31-26(37)38-20(27(2,3)4)15-21-32-33-25(39-21)16-10-12-17(28)13-11-16/h10-13,18-20H,5-9,14-15H2,1-4H3,(H,29,35)(H,30,36)(H,31,37)/t18-,19-,20?/m0/s1
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n/an/a 1.50E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 5 lM Cbz-Phe-Arg-AMC bindign to human cathepsin L activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin (B and K)


(Homo sapiens (Human))
BDBM50169484
PNG
((R)-1-(5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl)-3,...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)NCc1cccnc1
Show InChI InChI=1S/C28H34FN5O5/c1-5-6-9-21(24(35)25(36)31-17-18-8-7-14-30-16-18)32-27(37)38-22(28(2,3)4)15-23-33-34-26(39-23)19-10-12-20(29)13-11-19/h7-8,10-14,16,21-22H,5-6,9,15,17H2,1-4H3,(H,31,36)(H,32,37)/t21-,22+/m0/s1
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n/an/a 1.80E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin B activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169492
PNG
((R)-3,3-dimethyl-1-(5-(4-(trifluoromethyl)phenyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(cc1)C(F)(F)F)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H37F3N4O5/c1-6-7-13-23(26(39)27(40)35-19(2)20-11-9-8-10-12-20)36-29(41)42-24(30(3,4)5)18-25-37-38-28(43-25)21-14-16-22(17-15-21)31(32,33)34/h8-12,14-17,19,23-24H,6-7,13,18H2,1-5H3,(H,35,40)(H,36,41)/t19-,23+,24-/m1/s1
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n/an/a 410n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin K in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169481
PNG
(CHEMBL189604 | [(S)-1-(1-Phenyl-ethylaminooxalyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C29H36N4O5/c1-5-6-17-23(26(34)27(35)30-20(4)21-13-9-7-10-14-21)31-29(36)37-24(19(2)3)18-25-32-33-28(38-25)22-15-11-8-12-16-22/h7-16,19-20,23-24H,5-6,17-18H2,1-4H3,(H,30,35)(H,31,36)/t20-,23+,24-/m1/s1
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n/an/a 830n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin K in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169494
PNG
((S)-3,3-dimethyl-1-(5-phenyl-1,3,4-oxadiazol-2-yl)...)
Show SMILES CCCC[C@H](NC(=O)O[C@@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C30H38N4O5/c1-6-7-18-23(26(35)27(36)31-20(2)21-14-10-8-11-15-21)32-29(37)38-24(30(3,4)5)19-25-33-34-28(39-25)22-16-12-9-13-17-22/h8-17,20,23-24H,6-7,18-19H2,1-5H3,(H,31,36)(H,32,37)/t20-,23+,24+/m1/s1
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n/an/a 4.60E+5n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin K in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin (B and K)


(Homo sapiens (Human))
BDBM50169492
PNG
((R)-3,3-dimethyl-1-(5-(4-(trifluoromethyl)phenyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(cc1)C(F)(F)F)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H37F3N4O5/c1-6-7-13-23(26(39)27(40)35-19(2)20-11-9-8-10-12-20)36-29(41)42-24(30(3,4)5)18-25-37-38-28(43-25)21-14-16-22(17-15-21)31(32,33)34/h8-12,14-17,19,23-24H,6-7,13,18H2,1-5H3,(H,35,40)(H,36,41)/t19-,23+,24-/m1/s1
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n/an/a 3.20E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin B activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin V


(Homo sapiens (Human))
BDBM50169492
PNG
((R)-3,3-dimethyl-1-(5-(4-(trifluoromethyl)phenyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(cc1)C(F)(F)F)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H37F3N4O5/c1-6-7-13-23(26(39)27(40)35-19(2)20-11-9-8-10-12-20)36-29(41)42-24(30(3,4)5)18-25-37-38-28(43-25)21-14-16-22(17-15-21)31(32,33)34/h8-12,14-17,19,23-24H,6-7,13,18H2,1-5H3,(H,35,40)(H,36,41)/t19-,23+,24-/m1/s1
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n/an/a 5.00E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 2 lM Cbz-Phe-Arg-AMC binding to human cathepsin V activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169487
PNG
(CHEMBL426617 | [(S)-1-((S)-2-Oxo-piperidin-3-ylami...)
Show SMILES CCCC[C@H](NC(=O)OC(Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)N[C@H]1CCCNC1=O
Show InChI InChI=1S/C27H36FN5O6/c1-5-6-8-18(22(34)24(36)30-19-9-7-14-29-23(19)35)31-26(37)38-20(27(2,3)4)15-21-32-33-25(39-21)16-10-12-17(28)13-11-16/h10-13,18-20H,5-9,14-15H2,1-4H3,(H,29,35)(H,30,36)(H,31,37)/t18-,19-,20?/m0/s1
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n/an/a 650n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin K in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169484
PNG
((R)-1-(5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl)-3,...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)NCc1cccnc1
Show InChI InChI=1S/C28H34FN5O5/c1-5-6-9-21(24(35)25(36)31-17-18-8-7-14-30-16-18)32-27(37)38-22(28(2,3)4)15-23-33-34-26(39-23)19-10-12-20(29)13-11-19/h7-8,10-14,16,21-22H,5-6,9,15,17H2,1-4H3,(H,31,36)(H,32,37)/t21-,22+/m0/s1
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n/an/a 2.80E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin K in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))
BDBM50169481
PNG
(CHEMBL189604 | [(S)-1-(1-Phenyl-ethylaminooxalyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C29H36N4O5/c1-5-6-17-23(26(34)27(35)30-20(4)21-13-9-7-10-14-21)31-29(36)37-24(19(2)3)18-25-32-33-28(38-25)22-15-11-8-12-16-22/h7-16,19-20,23-24H,5-6,17-18H2,1-4H3,(H,30,35)(H,31,36)/t20-,23+,24-/m1/s1
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n/an/a 3.70E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Val-Val-Arg-AMC binding to human cathepsin S in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))
BDBM50169496
PNG
((R)-3,3-dimethyl-1-(5-phenyl-1,3,4-oxadiazol-2-yl)...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C30H38N4O5/c1-6-7-18-23(26(35)27(36)31-20(2)21-14-10-8-11-15-21)32-29(37)38-24(30(3,4)5)19-25-33-34-28(39-25)22-16-12-9-13-17-22/h8-17,20,23-24H,6-7,18-19H2,1-5H3,(H,31,36)(H,32,37)/t20-,23+,24-/m1/s1
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n/an/a 750n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Val-Val-Arg-AMC binding to human cathepsin S in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin L1


(Homo sapiens (Human))
BDBM50169486
PNG
(CHEMBL188563 | [(S)-1-(1-Phenyl-ethylaminooxalyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)CC)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H40N4O5/c1-6-8-19-24(27(36)28(37)32-21(3)22-15-11-9-12-16-22)33-30(38)39-25(31(4,5)7-2)20-26-34-35-29(40-26)23-17-13-10-14-18-23/h9-18,21,24-25H,6-8,19-20H2,1-5H3,(H,32,37)(H,33,38)/t21-,24+,25-/m1/s1
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n/an/a 1.70E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 5 lM Cbz-Phe-Arg-AMC bindign to human cathepsin L activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin V


(Homo sapiens (Human))
BDBM50169486
PNG
(CHEMBL188563 | [(S)-1-(1-Phenyl-ethylaminooxalyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)CC)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H40N4O5/c1-6-8-19-24(27(36)28(37)32-21(3)22-15-11-9-12-16-22)33-30(38)39-25(31(4,5)7-2)20-26-34-35-29(40-26)23-17-13-10-14-18-23/h9-18,21,24-25H,6-8,19-20H2,1-5H3,(H,32,37)(H,33,38)/t21-,24+,25-/m1/s1
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n/an/a 2.80E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 2 lM Cbz-Phe-Arg-AMC binding to human cathepsin V activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169496
PNG
((R)-3,3-dimethyl-1-(5-phenyl-1,3,4-oxadiazol-2-yl)...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C30H38N4O5/c1-6-7-18-23(26(35)27(36)31-20(2)21-14-10-8-11-15-21)32-29(37)38-24(30(3,4)5)19-25-33-34-28(39-25)22-16-12-9-13-17-22/h8-17,20,23-24H,6-7,18-19H2,1-5H3,(H,31,36)(H,32,37)/t20-,23+,24-/m1/s1
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n/an/a 240n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin K in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))
BDBM50169487
PNG
(CHEMBL426617 | [(S)-1-((S)-2-Oxo-piperidin-3-ylami...)
Show SMILES CCCC[C@H](NC(=O)OC(Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)N[C@H]1CCCNC1=O
Show InChI InChI=1S/C27H36FN5O6/c1-5-6-8-18(22(34)24(36)30-19-9-7-14-29-23(19)35)31-26(37)38-20(27(2,3)4)15-21-32-33-25(39-21)16-10-12-17(28)13-11-16/h10-13,18-20H,5-9,14-15H2,1-4H3,(H,29,35)(H,30,36)(H,31,37)/t18-,19-,20?/m0/s1
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n/an/a 810n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Val-Val-Arg-AMC binding to human cathepsin S in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin V


(Homo sapiens (Human))
BDBM50169481
PNG
(CHEMBL189604 | [(S)-1-(1-Phenyl-ethylaminooxalyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C29H36N4O5/c1-5-6-17-23(26(34)27(35)30-20(4)21-13-9-7-10-14-21)31-29(36)37-24(19(2)3)18-25-32-33-28(38-25)22-15-11-8-12-16-22/h7-16,19-20,23-24H,5-6,17-18H2,1-4H3,(H,30,35)(H,31,36)/t20-,23+,24-/m1/s1
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n/an/a 5.60E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 2 lM Cbz-Phe-Arg-AMC binding to human cathepsin V activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin L1


(Homo sapiens (Human))
BDBM50169484
PNG
((R)-1-(5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl)-3,...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)NCc1cccnc1
Show InChI InChI=1S/C28H34FN5O5/c1-5-6-9-21(24(35)25(36)31-17-18-8-7-14-30-16-18)32-27(37)38-22(28(2,3)4)15-23-33-34-26(39-23)19-10-12-20(29)13-11-19/h7-8,10-14,16,21-22H,5-6,9,15,17H2,1-4H3,(H,31,36)(H,32,37)/t21-,22+/m0/s1
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n/an/a 1.30E+5n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 5 lM Cbz-Phe-Arg-AMC bindign to human cathepsin L activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin L1


(Homo sapiens (Human))
BDBM50169496
PNG
((R)-3,3-dimethyl-1-(5-phenyl-1,3,4-oxadiazol-2-yl)...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C30H38N4O5/c1-6-7-18-23(26(35)27(36)31-20(2)21-14-10-8-11-15-21)32-29(37)38-24(30(3,4)5)19-25-33-34-28(39-25)22-16-12-9-13-17-22/h8-17,20,23-24H,6-7,18-19H2,1-5H3,(H,31,36)(H,32,37)/t20-,23+,24-/m1/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 5 lM Cbz-Phe-Arg-AMC bindign to human cathepsin L activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))
BDBM50169492
PNG
((R)-3,3-dimethyl-1-(5-(4-(trifluoromethyl)phenyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(cc1)C(F)(F)F)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H37F3N4O5/c1-6-7-13-23(26(39)27(40)35-19(2)20-11-9-8-10-12-20)36-29(41)42-24(30(3,4)5)18-25-37-38-28(43-25)21-14-16-22(17-15-21)31(32,33)34/h8-12,14-17,19,23-24H,6-7,13,18H2,1-5H3,(H,35,40)(H,36,41)/t19-,23+,24-/m1/s1
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n/an/a 1.60E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Val-Val-Arg-AMC binding to human cathepsin S in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin (B and K)


(Homo sapiens (Human))
BDBM50169496
PNG
((R)-3,3-dimethyl-1-(5-phenyl-1,3,4-oxadiazol-2-yl)...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C30H38N4O5/c1-6-7-18-23(26(35)27(36)31-20(2)21-14-10-8-11-15-21)32-29(37)38-24(30(3,4)5)19-25-33-34-28(39-25)22-16-12-9-13-17-22/h8-17,20,23-24H,6-7,18-19H2,1-5H3,(H,31,36)(H,32,37)/t20-,23+,24-/m1/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin B activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin (B and K)


(Homo sapiens (Human))
BDBM50169487
PNG
(CHEMBL426617 | [(S)-1-((S)-2-Oxo-piperidin-3-ylami...)
Show SMILES CCCC[C@H](NC(=O)OC(Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)N[C@H]1CCCNC1=O
Show InChI InChI=1S/C27H36FN5O6/c1-5-6-8-18(22(34)24(36)30-19-9-7-14-29-23(19)35)31-26(37)38-20(27(2,3)4)15-21-32-33-25(39-21)16-10-12-17(28)13-11-16/h10-13,18-20H,5-9,14-15H2,1-4H3,(H,29,35)(H,30,36)(H,31,37)/t18-,19-,20?/m0/s1
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n/an/a 6.20E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin B activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin V


(Homo sapiens (Human))
BDBM50169487
PNG
(CHEMBL426617 | [(S)-1-((S)-2-Oxo-piperidin-3-ylami...)
Show SMILES CCCC[C@H](NC(=O)OC(Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)N[C@H]1CCCNC1=O
Show InChI InChI=1S/C27H36FN5O6/c1-5-6-8-18(22(34)24(36)30-19-9-7-14-29-23(19)35)31-26(37)38-20(27(2,3)4)15-21-32-33-25(39-21)16-10-12-17(28)13-11-16/h10-13,18-20H,5-9,14-15H2,1-4H3,(H,29,35)(H,30,36)(H,31,37)/t18-,19-,20?/m0/s1
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n/an/a 1.30E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 2 lM Cbz-Phe-Arg-AMC binding to human cathepsin V activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin V


(Homo sapiens (Human))
BDBM50169484
PNG
((R)-1-(5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl)-3,...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)NCc1cccnc1
Show InChI InChI=1S/C28H34FN5O5/c1-5-6-9-21(24(35)25(36)31-17-18-8-7-14-30-16-18)32-27(37)38-22(28(2,3)4)15-23-33-34-26(39-23)19-10-12-20(29)13-11-19/h7-8,10-14,16,21-22H,5-6,9,15,17H2,1-4H3,(H,31,36)(H,32,37)/t21-,22+/m0/s1
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n/an/a 1.40E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 2 lM Cbz-Phe-Arg-AMC binding to human cathepsin V activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin V


(Homo sapiens (Human))
BDBM50169496
PNG
((R)-3,3-dimethyl-1-(5-phenyl-1,3,4-oxadiazol-2-yl)...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C30H38N4O5/c1-6-7-18-23(26(35)27(36)31-20(2)21-14-10-8-11-15-21)32-29(37)38-24(30(3,4)5)19-25-33-34-28(39-25)22-16-12-9-13-17-22/h8-17,20,23-24H,6-7,18-19H2,1-5H3,(H,31,36)(H,32,37)/t20-,23+,24-/m1/s1
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n/an/a 1.60E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 2 lM Cbz-Phe-Arg-AMC binding to human cathepsin V activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin (B and K)


(Homo sapiens (Human))
BDBM50169481
PNG
(CHEMBL189604 | [(S)-1-(1-Phenyl-ethylaminooxalyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C29H36N4O5/c1-5-6-17-23(26(34)27(35)30-20(4)21-13-9-7-10-14-21)31-29(36)37-24(19(2)3)18-25-32-33-28(38-25)22-15-11-8-12-16-22/h7-16,19-20,23-24H,5-6,17-18H2,1-4H3,(H,30,35)(H,31,36)/t20-,23+,24-/m1/s1
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n/an/a 3.10E+4n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin B activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169486
PNG
(CHEMBL188563 | [(S)-1-(1-Phenyl-ethylaminooxalyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)CC)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H40N4O5/c1-6-8-19-24(27(36)28(37)32-21(3)22-15-11-9-12-16-22)33-30(38)39-25(31(4,5)7-2)20-26-34-35-29(40-26)23-17-13-10-14-18-23/h9-18,21,24-25H,6-8,19-20H2,1-5H3,(H,32,37)(H,33,38)/t21-,24+,25-/m1/s1
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n/an/a 1.50E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Phe-Arg-AMC binding to human cathepsin K in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin L1


(Homo sapiens (Human))
BDBM50169492
PNG
((R)-3,3-dimethyl-1-(5-(4-(trifluoromethyl)phenyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(cc1)C(F)(F)F)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H37F3N4O5/c1-6-7-13-23(26(39)27(40)35-19(2)20-11-9-8-10-12-20)36-29(41)42-24(30(3,4)5)18-25-37-38-28(43-25)21-14-16-22(17-15-21)31(32,33)34/h8-12,14-17,19,23-24H,6-7,13,18H2,1-5H3,(H,35,40)(H,36,41)/t19-,23+,24-/m1/s1
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n/an/a 1.90E+5n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 5 lM Cbz-Phe-Arg-AMC bindign to human cathepsin L activity in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169484
PNG
((R)-1-(5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl)-3,...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)NCc1cccnc1
Show InChI InChI=1S/C28H34FN5O5/c1-5-6-9-21(24(35)25(36)31-17-18-8-7-14-30-16-18)32-27(37)38-22(28(2,3)4)15-23-33-34-26(39-23)19-10-12-20(29)13-11-19/h7-8,10-14,16,21-22H,5-6,9,15,17H2,1-4H3,(H,31,36)(H,32,37)/t21-,22+/m0/s1
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n/an/a 2.82n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin K


Eur J Med Chem 45: 667-81 (2010)


Article DOI: 10.1016/j.ejmech.2009.11.010
BindingDB Entry DOI: 10.7270/Q29C6ZP1
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169492
PNG
((R)-3,3-dimethyl-1-(5-(4-(trifluoromethyl)phenyl)-...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(cc1)C(F)(F)F)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C31H37F3N4O5/c1-6-7-13-23(26(39)27(40)35-19(2)20-11-9-8-10-12-20)36-29(41)42-24(30(3,4)5)18-25-37-38-28(43-25)21-14-16-22(17-15-21)31(32,33)34/h8-12,14-17,19,23-24H,6-7,13,18H2,1-5H3,(H,35,40)(H,36,41)/t19-,23+,24-/m1/s1
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n/an/a 0.407n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin K


Eur J Med Chem 45: 667-81 (2010)


Article DOI: 10.1016/j.ejmech.2009.11.010
BindingDB Entry DOI: 10.7270/Q29C6ZP1
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50415755
PNG
(CHEMBL1087934)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)N[C@H]1CCCNC1=O
Show InChI InChI=1/C27H36FN5O6/c1-5-6-8-18(22(34)24(36)30-19-9-7-14-29-23(19)35)31-26(37)38-20(27(2,3)4)15-21-32-33-25(39-21)16-10-12-17(28)13-11-16/h10-13,18-20H,5-9,14-15H2,1-4H3,(H,29,35)(H,30,36)(H,31,37)/t18-,19-,20+/s2
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n/an/a 0.646n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin K


Eur J Med Chem 45: 667-81 (2010)


Article DOI: 10.1016/j.ejmech.2009.11.010
BindingDB Entry DOI: 10.7270/Q29C6ZP1
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169496
PNG
((R)-3,3-dimethyl-1-(5-phenyl-1,3,4-oxadiazol-2-yl)...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C30H38N4O5/c1-6-7-18-23(26(35)27(36)31-20(2)21-14-10-8-11-15-21)32-29(37)38-24(30(3,4)5)19-25-33-34-28(39-25)22-16-12-9-13-17-22/h8-17,20,23-24H,6-7,18-19H2,1-5H3,(H,31,36)(H,32,37)/t20-,23+,24-/m1/s1
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n/an/a 0.240n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin K


Eur J Med Chem 45: 667-81 (2010)


Article DOI: 10.1016/j.ejmech.2009.11.010
BindingDB Entry DOI: 10.7270/Q29C6ZP1
More data for this
Ligand-Target Pair
Cathepsin K


(Homo sapiens (Human))
BDBM50169494
PNG
((S)-3,3-dimethyl-1-(5-phenyl-1,3,4-oxadiazol-2-yl)...)
Show SMILES CCCC[C@H](NC(=O)O[C@@H](Cc1nnc(o1)-c1ccccc1)C(C)(C)C)C(=O)C(=O)N[C@H](C)c1ccccc1
Show InChI InChI=1S/C30H38N4O5/c1-6-7-18-23(26(35)27(36)31-20(2)21-14-10-8-11-15-21)32-29(37)38-24(30(3,4)5)19-25-33-34-28(39-25)22-16-12-9-13-17-22/h8-17,20,23-24H,6-7,18-19H2,1-5H3,(H,31,36)(H,32,37)/t20-,23+,24+/m1/s1
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n/an/a 457n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human cathepsin K


Eur J Med Chem 45: 667-81 (2010)


Article DOI: 10.1016/j.ejmech.2009.11.010
BindingDB Entry DOI: 10.7270/Q29C6ZP1
More data for this
Ligand-Target Pair
Cathepsin S


(Homo sapiens (Human))
BDBM50169484
PNG
((R)-1-(5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl)-3,...)
Show SMILES CCCC[C@H](NC(=O)O[C@H](Cc1nnc(o1)-c1ccc(F)cc1)C(C)(C)C)C(=O)C(=O)NCc1cccnc1
Show InChI InChI=1S/C28H34FN5O5/c1-5-6-9-21(24(35)25(36)31-17-18-8-7-14-30-16-18)32-27(37)38-22(28(2,3)4)15-23-33-34-26(39-23)19-10-12-20(29)13-11-19/h7-8,10-14,16,21-22H,5-6,9,15,17H2,1-4H3,(H,31,36)(H,32,37)/t21-,22+/m0/s1
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n/an/a 2.70E+3n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of 10 lM Cbz-Val-Val-Arg-AMC binding to human cathepsin S in fluorescence assay with 100 mM NaOAc


Bioorg Med Chem Lett 15: 3540-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.05.062
BindingDB Entry DOI: 10.7270/Q2FQ9W59
More data for this
Ligand-Target Pair