Found 14 hits with Last Name = 'browe' and Initial = 'c' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Cathepsin K
(Homo sapiens (Human)) | BDBM19807
(CHEMBL100563 | benzyl N-[(1S)-1-({1-[(2S)-2-{[(ben...)Show SMILES CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NC1CN(CC1=O)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C32H42N4O7/c1-21(2)15-25(34-31(40)42-19-23-11-7-5-8-12-23)29(38)33-27-17-36(18-28(27)37)30(39)26(16-22(3)4)35-32(41)43-20-24-13-9-6-10-14-24/h5-14,21-22,25-27H,15-20H2,1-4H3,(H,33,38)(H,34,40)(H,35,41)/t25-,26-,27?/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
PDB
UniChem
Similars
| PubMed
| 2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity of the compound against Cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | 
3D Structure (docked) |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106075
((S)-1-[2-Oxo-2-(3,4,5-trimethoxy-phenyl)-ethyl]-pi...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1cc(OC)c(OC)c(OC)c1)\C=C\c1ccccc1 Show InChI InChI=1S/C30H40N2O5/c1-6-21(2)24(16-15-22-12-8-7-9-13-22)31-30(34)25-14-10-11-17-32(25)20-26(33)23-18-27(35-3)29(37-5)28(19-23)36-4/h7-9,12-13,15-16,18-19,21,24-25H,6,10-11,14,17,20H2,1-5H3,(H,31,34)/b16-15+/t21-,24+,25-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 790 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity of the compound against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106079
((S)-1-(2-Oxo-2-phenyl-ethyl)-piperidine-2-carboxyl...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1ccccc1)\C=C\c1ccccc1 Show InChI InChI=1S/C27H34N2O2/c1-3-21(2)24(18-17-22-12-6-4-7-13-22)28-27(31)25-16-10-11-19-29(25)20-26(30)23-14-8-5-9-15-23/h4-9,12-15,17-18,21,24-25H,3,10-11,16,19-20H2,1-2H3,(H,28,31)/b18-17+/t21-,24+,25-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106077
((S)-1-[2-(4-Chloro-phenyl)-2-oxo-ethyl]-piperidine...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1ccc(Cl)cc1)\C=C\c1ccccc1 Show InChI InChI=1S/C27H33ClN2O2/c1-3-20(2)24(17-12-21-9-5-4-6-10-21)29-27(32)25-11-7-8-18-30(25)19-26(31)22-13-15-23(28)16-14-22/h4-6,9-10,12-17,20,24-25H,3,7-8,11,18-19H2,1-2H3,(H,29,32)/b17-12+/t20-,24+,25-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106076
((S)-1-[2-(4-Methoxy-phenyl)-2-oxo-ethyl]-piperidin...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1ccc(OC)cc1)\C=C\c1ccccc1 Show InChI InChI=1S/C28H36N2O3/c1-4-21(2)25(18-13-22-10-6-5-7-11-22)29-28(32)26-12-8-9-19-30(26)20-27(31)23-14-16-24(33-3)17-15-23/h5-7,10-11,13-18,21,25-26H,4,8-9,12,19-20H2,1-3H3,(H,29,32)/b18-13+/t21-,25+,26-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 410 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106074
((S)-1-(2-Oxo-2-phenyl-ethyl)-piperidine-2-carboxyl...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1ccccc1)\C=C\c1ccccc1C Show InChI InChI=1S/C28H36N2O2/c1-4-21(2)25(18-17-23-13-9-8-12-22(23)3)29-28(32)26-16-10-11-19-30(26)20-27(31)24-14-6-5-7-15-24/h5-9,12-15,17-18,21,25-26H,4,10-11,16,19-20H2,1-3H3,(H,29,32)/b18-17+/t21-,25+,26-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106070
((S)-1-(2-Benzo[1,3]dioxol-5-yl-2-oxo-ethyl)-piperi...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1ccc2OCOc2c1)\C=C\c1ccccc1 Show InChI InChI=1S/C28H34N2O4/c1-3-20(2)23(14-12-21-9-5-4-6-10-21)29-28(32)24-11-7-8-16-30(24)18-25(31)22-13-15-26-27(17-22)34-19-33-26/h4-6,9-10,12-15,17,20,23-24H,3,7-8,11,16,18-19H2,1-2H3,(H,29,32)/b14-12+/t20-,23+,24-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106072
((S)-1-[2-(2,6-Dimethoxy-phenyl)-2-oxo-ethyl]-piper...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1c(OC)cccc1OC)\C=C\c1ccccc1 Show InChI InChI=1S/C29H38N2O4/c1-5-21(2)23(18-17-22-12-7-6-8-13-22)30-29(33)24-14-9-10-19-31(24)20-25(32)28-26(34-3)15-11-16-27(28)35-4/h6-8,11-13,15-18,21,23-24H,5,9-10,14,19-20H2,1-4H3,(H,30,33)/b18-17+/t21-,23+,24-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106080
((S)-1-(2-Oxo-2-phenyl-ethyl)-piperidine-2-carboxyl...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1ccccc1)\C=C\c1ccc(C)cc1 Show InChI InChI=1S/C28H36N2O2/c1-4-22(3)25(18-17-23-15-13-21(2)14-16-23)29-28(32)26-12-8-9-19-30(26)20-27(31)24-10-6-5-7-11-24/h5-7,10-11,13-18,22,25-26H,4,8-9,12,19-20H2,1-3H3,(H,29,32)/b18-17+/t22-,25+,26-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 740 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106078
((S)-1-(2-Oxo-2-phenyl-ethyl)-piperidine-2-carboxyl...)Show SMILES CC(C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1ccccc1)\C=C\c1ccccc1 Show InChI InChI=1S/C26H32N2O2/c1-20(2)23(17-16-21-11-5-3-6-12-21)27-26(30)24-15-9-10-18-28(24)19-25(29)22-13-7-4-8-14-22/h3-8,11-14,16-17,20,23-24H,9-10,15,18-19H2,1-2H3,(H,27,30)/b17-16+/t23-,24+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 780 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity of the compound against Cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106081
((S)-1-(2-Oxo-2-phenyl-ethyl)-piperidine-2-carboxyl...)Show SMILES CC(C)C[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1ccccc1)\C=C\c1ccccc1 Show InChI InChI=1S/C27H34N2O2/c1-21(2)19-24(17-16-22-11-5-3-6-12-22)28-27(31)25-15-9-10-18-29(25)20-26(30)23-13-7-4-8-14-23/h3-8,11-14,16-17,21,24-25H,9-10,15,18-20H2,1-2H3,(H,28,31)/b17-16+/t24-,25+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 840 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106075
((S)-1-[2-Oxo-2-(3,4,5-trimethoxy-phenyl)-ethyl]-pi...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1cc(OC)c(OC)c(OC)c1)\C=C\c1ccccc1 Show InChI InChI=1S/C30H40N2O5/c1-6-21(2)24(16-15-22-12-8-7-9-13-22)31-30(34)25-14-10-11-17-32(25)20-26(33)23-18-27(35-3)29(37-5)28(19-23)36-4/h7-9,12-13,15-16,18-19,21,24-25H,6,10-11,14,17,20H2,1-5H3,(H,31,34)/b16-15+/t21-,24+,25-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106071
((S)-1-(2-Oxo-2-phenyl-ethyl)-piperidine-2-carboxyl...)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCCN1CC(=O)c1ccccc1)\C=C\c1ccc(Cl)cc1 Show InChI InChI=1S/C27H33ClN2O2/c1-3-20(2)24(17-14-21-12-15-23(28)16-13-21)29-27(32)25-11-7-8-18-30(25)19-26(31)22-9-5-4-6-10-22/h4-6,9-10,12-17,20,24-25H,3,7-8,11,18-19H2,1-2H3,(H,29,32)/b17-14+/t20-,24+,25-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50106073
((S)-1-[2-Oxo-2-(3,4,5-trimethoxy-phenyl)-ethyl]-pi...)Show SMILES COc1cc(cc(OC)c1OC)C(=O)CN1CCCC[C@H]1C(=O)N[C@@H](CC(C)C)\C=C\c1ccccc1 Show InChI InChI=1S/C30H40N2O5/c1-21(2)17-24(15-14-22-11-7-6-8-12-22)31-30(34)25-13-9-10-16-32(25)20-26(33)23-18-27(35-3)29(37-5)28(19-23)36-4/h6-8,11-12,14-15,18-19,21,24-25H,9-10,13,16-17,20H2,1-5H3,(H,31,34)/b15-14+/t24-,25+/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bayer Research Center
Curated by ChEMBL
| Assay Description
Inhibitory activity against cathepsin K |
Bioorg Med Chem Lett 11: 2951-4 (2001)
BindingDB Entry DOI: 10.7270/Q23R0S5W |
More data for this
Ligand-Target Pair | |
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