Found 85 hits of Enzyme Inhibition Constant Data 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 S
(Homo sapiens (Human)) | BDBM50252500
(6-(4-chlorobenzyl)-7-(3,3-dimethylbutyl)-7H-pyrrol...)Show SMILES CC(C)(C)CCn1c(Cc2ccc(Cl)cc2)cc2cnc(nc12)C#N Show InChI InChI=1S/C20H21ClN4/c1-20(2,3)8-9-25-17(10-14-4-6-16(21)7-5-14)11-15-13-23-18(12-22)24-19(15)25/h4-7,11,13H,8-10H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50251889
(4-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,3-d...)Show SMILES NC(=O)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C23H25N5O2/c24-13-21-26-14-18-12-19(15-30-20-8-6-17(7-9-20)22(25)29)28(23(18)27-21)11-10-16-4-2-1-3-5-16/h6-9,12,14,16H,1-5,10-11,15H2,(H2,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50251887
(3-(3-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,...)Show SMILES OC(=O)CCc1cccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)c1 Show InChI InChI=1S/C25H28N4O3/c26-15-23-27-16-20-14-21(17-32-22-8-4-7-19(13-22)9-10-24(30)31)29(25(20)28-23)12-11-18-5-2-1-3-6-18/h4,7-8,13-14,16,18H,1-3,5-6,9-12,17H2,(H,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252656
(7-(2-cyclohexylethyl)-6-((pyridin-4-yloxy)methyl)-...)Show InChI InChI=1S/C21H23N5S/c22-13-20-24-14-17-12-18(15-27-19-6-9-23-10-7-19)26(21(17)25-20)11-8-16-4-2-1-3-5-16/h6-7,9-10,12,14,16H,1-5,8,11,15H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252502
(6-(4-chlorobenzyl)-7-(cyclohexylmethyl)-7H-pyrrolo...)Show InChI InChI=1S/C21H21ClN4/c22-18-8-6-15(7-9-18)10-19-11-17-13-24-20(12-23)25-21(17)26(19)14-16-4-2-1-3-5-16/h6-9,11,13,16H,1-5,10,14H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252543
(6-(4-chlorobenzyl)-7-(2-cyclopentylethyl)-7H-pyrro...)Show InChI InChI=1S/C21H21ClN4/c22-18-7-5-16(6-8-18)11-19-12-17-14-24-20(13-23)25-21(17)26(19)10-9-15-3-1-2-4-15/h5-8,12,14-15H,1-4,9-11H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50251888
(3-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,3-d...)Show SMILES NC(=O)c1cccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)c1 Show InChI InChI=1S/C23H25N5O2/c24-13-21-26-14-18-11-19(15-30-20-8-4-7-17(12-20)22(25)29)28(23(18)27-21)10-9-16-5-2-1-3-6-16/h4,7-8,11-12,14,16H,1-3,5-6,9-10,15H2,(H2,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50251942
(CHEMBL520427 | N-(4-((2-cyano-7-(2-cyclohexylethyl...)Show SMILES CC(=O)Nc1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C24H27N5O2/c1-17(30)27-20-7-9-22(10-8-20)31-16-21-13-19-15-26-23(14-25)28-24(19)29(21)12-11-18-5-3-2-4-6-18/h7-10,13,15,18H,2-6,11-12,16H2,1H3,(H,27,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM25134
(2-cyano-pyrropyrimidine, 2 | 7-(2-cyclohexylethyl)...)Show SMILES CC(=O)N1CCN(CC1)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C28H34N6O2/c1-21(35)32-13-15-33(16-14-32)24-7-9-26(10-8-24)36-20-25-17-23-19-30-27(18-29)31-28(23)34(25)12-11-22-5-3-2-4-6-22/h7-10,17,19,22H,2-6,11-16,20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252654
(7-(2-cyclohexylethyl)-6-(phenoxymethyl)-7H-pyrrolo...)Show InChI InChI=1S/C22H24N4O/c23-14-21-24-15-18-13-19(16-27-20-9-5-2-6-10-20)26(22(18)25-21)12-11-17-7-3-1-4-8-17/h2,5-6,9-10,13,15,17H,1,3-4,7-8,11-12,16H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252655
(7-(2-cyclohexylethyl)-6-((pyridin-2-yloxy)methyl)-...)Show InChI InChI=1S/C21H23N5O/c22-13-19-24-14-17-12-18(15-27-20-8-4-5-10-23-20)26(21(17)25-19)11-9-16-6-2-1-3-7-16/h4-5,8,10,12,14,16H,1-3,6-7,9,11,15H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252036
(CHEMBL481169 | N-(4-((2-cyano-7-(2-cyclohexylethyl...)Show SMILES CCC(=O)Nc1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C25H29N5O2/c1-2-24(31)28-20-8-10-22(11-9-20)32-17-21-14-19-16-27-23(15-26)29-25(19)30(21)13-12-18-6-4-3-5-7-18/h8-11,14,16,18H,2-7,12-13,17H2,1H3,(H,28,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252038
(6-((4-(1-acetyl-1,2,3,6-tetrahydropyridin-4-yl)phe...)Show SMILES CC(=O)N1CCC(=CC1)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 |c:6| Show InChI InChI=1S/C29H33N5O2/c1-21(35)33-14-12-24(13-15-33)23-7-9-27(10-8-23)36-20-26-17-25-19-31-28(18-30)32-29(25)34(26)16-11-22-5-3-2-4-6-22/h7-10,12,17,19,22H,2-6,11,13-16,20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252037
(6-((4-(1-acetylpiperidin-4-yl)phenoxy)methyl)-7-(2...)Show SMILES CC(=O)N1CCC(CC1)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C29H35N5O2/c1-21(35)33-14-12-24(13-15-33)23-7-9-27(10-8-23)36-20-26-17-25-19-31-28(18-30)32-29(25)34(26)16-11-22-5-3-2-4-6-22/h7-10,17,19,22,24H,2-6,11-16,20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50251886
(4-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,3-d...)Show SMILES OC(=O)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C23H24N4O3/c24-13-21-25-14-18-12-19(15-30-20-8-6-17(7-9-20)23(28)29)27(22(18)26-21)11-10-16-4-2-1-3-5-16/h6-9,12,14,16H,1-5,10-11,15H2,(H,28,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252543
(6-(4-chlorobenzyl)-7-(2-cyclopentylethyl)-7H-pyrro...)Show InChI InChI=1S/C21H21ClN4/c22-18-7-5-16(6-8-18)11-19-12-17-14-24-20(13-23)25-21(17)26(19)10-9-15-3-1-2-4-15/h5-8,12,14-15H,1-4,9-11H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252500
(6-(4-chlorobenzyl)-7-(3,3-dimethylbutyl)-7H-pyrrol...)Show SMILES CC(C)(C)CCn1c(Cc2ccc(Cl)cc2)cc2cnc(nc12)C#N Show InChI InChI=1S/C20H21ClN4/c1-20(2,3)8-9-25-17(10-14-4-6-16(21)7-5-14)11-15-13-23-18(12-22)24-19(15)25/h4-7,11,13H,8-10H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252547
(6-(4-chlorobenzyl)-7-(4-chlorophenethyl)-7H-pyrrol...)Show SMILES Clc1ccc(CCn2c(Cc3ccc(Cl)cc3)cc3cnc(nc23)C#N)cc1 Show InChI InChI=1S/C22H16Cl2N4/c23-18-5-1-15(2-6-18)9-10-28-20(11-16-3-7-19(24)8-4-16)12-17-14-26-21(13-25)27-22(17)28/h1-8,12,14H,9-11H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252503
(6-(4-chlorobenzyl)-7-(2-cyclohexylethyl)-7H-pyrrol...)Show InChI InChI=1S/C22H23ClN4/c23-19-8-6-17(7-9-19)12-20-13-18-15-25-21(14-24)26-22(18)27(20)11-10-16-4-2-1-3-5-16/h6-9,13,15-16H,1-5,10-12H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252546
(6-(4-chlorobenzyl)-7-phenethyl-7H-pyrrolo[2,3-d]py...)Show InChI InChI=1S/C22H17ClN4/c23-19-8-6-17(7-9-19)12-20-13-18-15-25-21(14-24)26-22(18)27(20)11-10-16-4-2-1-3-5-16/h1-9,13,15H,10-12H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 23 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252652
(7-(2-cyclohexylethyl)-6-((phenylamino)methyl)-7H-p...)Show InChI InChI=1S/C22H25N5/c23-14-21-25-15-18-13-20(16-24-19-9-5-2-6-10-19)27(22(18)26-21)12-11-17-7-3-1-4-8-17/h2,5-6,9-10,13,15,17,24H,1,3-4,7-8,11-12,16H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252544
(6-(4-chlorobenzyl)-7-(2-cycloheptylethyl)-7H-pyrro...)Show InChI InChI=1S/C23H25ClN4/c24-20-9-7-18(8-10-20)13-21-14-19-16-26-22(15-25)27-23(19)28(21)12-11-17-5-3-1-2-4-6-17/h7-10,14,16-17H,1-6,11-13H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252596
(7-(3-chlorophenethyl)-6-(4-chlorobenzyl)-7H-pyrrol...)Show SMILES Clc1ccc(Cc2cc3cnc(nc3n2CCc2cccc(Cl)c2)C#N)cc1 Show InChI InChI=1S/C22H16Cl2N4/c23-18-6-4-16(5-7-18)11-20-12-17-14-26-21(13-25)27-22(17)28(20)9-8-15-2-1-3-19(24)10-15/h1-7,10,12,14H,8-9,11H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252653
(7-(2-cyclohexylethyl)-6-((methyl(phenyl)amino)meth...)Show InChI InChI=1S/C23H27N5/c1-27(20-10-6-3-7-11-20)17-21-14-19-16-25-22(15-24)26-23(19)28(21)13-12-18-8-4-2-5-9-18/h3,6-7,10-11,14,16,18H,2,4-5,8-9,12-13,17H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 52 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252546
(6-(4-chlorobenzyl)-7-phenethyl-7H-pyrrolo[2,3-d]py...)Show InChI InChI=1S/C22H17ClN4/c23-19-8-6-17(7-9-19)12-20-13-18-15-25-21(14-24)26-22(18)27(20)11-10-16-4-2-1-3-5-16/h1-9,13,15H,10-12H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 64 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252547
(6-(4-chlorobenzyl)-7-(4-chlorophenethyl)-7H-pyrrol...)Show SMILES Clc1ccc(CCn2c(Cc3ccc(Cl)cc3)cc3cnc(nc23)C#N)cc1 Show InChI InChI=1S/C22H16Cl2N4/c23-18-5-1-15(2-6-18)9-10-28-20(11-16-3-7-19(24)8-4-16)12-17-14-26-21(13-25)27-22(17)28/h1-8,12,14H,9-11H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 86 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50223938
(6-(4-chlorobenzyl)-7-neopentyl-7H-pyrrolo[2,3-d]py...)Show InChI InChI=1S/C19H19ClN4/c1-19(2,3)12-24-16(8-13-4-6-15(20)7-5-13)9-14-11-22-17(10-21)23-18(14)24/h4-7,9,11H,8,12H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 96 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252545
(6-(4-chlorobenzyl)-7-(2-cyclooctylethyl)-7H-pyrrol...)Show SMILES Clc1ccc(Cc2cc3cnc(nc3n2CCC2CCCCCCC2)C#N)cc1 Show InChI InChI=1S/C24H27ClN4/c25-21-10-8-19(9-11-21)14-22-15-20-17-27-23(16-26)28-24(20)29(22)13-12-18-6-4-2-1-3-5-7-18/h8-11,15,17-18H,1-7,12-14H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 99 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252546
(6-(4-chlorobenzyl)-7-phenethyl-7H-pyrrolo[2,3-d]py...)Show InChI InChI=1S/C22H17ClN4/c23-19-8-6-17(7-9-19)12-20-13-18-15-25-21(14-24)26-22(18)27(20)11-10-16-4-2-1-3-5-16/h1-9,13,15H,10-12H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252501
(6-(4-chlorobenzyl)-7-(4,4-dimethylpentyl)-7H-pyrro...)Show SMILES CC(C)(C)CCCn1c(Cc2ccc(Cl)cc2)cc2cnc(nc12)C#N Show InChI InChI=1S/C21H23ClN4/c1-21(2,3)9-4-10-26-18(11-15-5-7-17(22)8-6-15)12-16-14-24-19(13-23)25-20(16)26/h5-8,12,14H,4,9-11H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252502
(6-(4-chlorobenzyl)-7-(cyclohexylmethyl)-7H-pyrrolo...)Show InChI InChI=1S/C21H21ClN4/c22-18-8-6-15(7-9-18)10-19-11-17-13-24-20(12-23)25-21(17)26(19)14-16-4-2-1-3-5-16/h6-9,11,13,16H,1-5,10,14H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252598
(6-(4-methoxybenzyl)-7-(2-cyclohexylethyl)-7H-pyrro...)Show InChI InChI=1S/C23H26N4O/c1-28-21-9-7-18(8-10-21)13-20-14-19-16-25-22(15-24)26-23(19)27(20)12-11-17-5-3-2-4-6-17/h7-10,14,16-17H,2-6,11-13H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252600
(7-(2-cyclohexylethyl)-6-(cyclohexylmethyl)-7H-pyrr...)Show InChI InChI=1S/C22H30N4/c23-15-21-24-16-19-14-20(13-18-9-5-2-6-10-18)26(22(19)25-21)12-11-17-7-3-1-4-8-17/h14,16-18H,1-13H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252504
(6-(4-chlorobenzyl)-7-(3-cyclohexylpropyl)-7H-pyrro...)Show InChI InChI=1S/C23H25ClN4/c24-20-10-8-18(9-11-20)13-21-14-19-16-26-22(15-25)27-23(19)28(21)12-4-7-17-5-2-1-3-6-17/h8-11,14,16-17H,1-7,12-13H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252596
(7-(3-chlorophenethyl)-6-(4-chlorobenzyl)-7H-pyrrol...)Show SMILES Clc1ccc(Cc2cc3cnc(nc3n2CCc2cccc(Cl)c2)C#N)cc1 Show InChI InChI=1S/C22H16Cl2N4/c23-18-6-4-16(5-7-18)11-20-12-17-14-26-21(13-25)27-22(17)28(20)9-8-15-2-1-3-19(24)10-15/h1-7,10,12,14H,8-9,11H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252503
(6-(4-chlorobenzyl)-7-(2-cyclohexylethyl)-7H-pyrrol...)Show InChI InChI=1S/C22H23ClN4/c23-19-8-6-17(7-9-19)12-20-13-18-15-25-21(14-24)26-22(18)27(20)11-10-16-4-2-1-3-5-16/h6-9,13,15-16H,1-5,10-12H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252655
(7-(2-cyclohexylethyl)-6-((pyridin-2-yloxy)methyl)-...)Show InChI InChI=1S/C21H23N5O/c22-13-19-24-14-17-12-18(15-27-20-8-4-5-10-23-20)26(21(17)25-19)11-9-16-6-2-1-3-7-16/h4-5,8,10,12,14,16H,1-3,6-7,9,11,15H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252543
(6-(4-chlorobenzyl)-7-(2-cyclopentylethyl)-7H-pyrro...)Show InChI InChI=1S/C21H21ClN4/c22-18-7-5-16(6-8-18)11-19-12-17-14-24-20(13-23)25-21(17)26(19)10-9-15-3-1-2-4-15/h5-8,12,14-15H,1-4,9-11H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 260 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50251889
(4-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,3-d...)Show SMILES NC(=O)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C23H25N5O2/c24-13-21-26-14-18-12-19(15-30-20-8-6-17(7-9-20)22(25)29)28(23(18)27-21)11-10-16-4-2-1-3-5-16/h6-9,12,14,16H,1-5,10-11,15H2,(H2,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252598
(6-(4-methoxybenzyl)-7-(2-cyclohexylethyl)-7H-pyrro...)Show InChI InChI=1S/C23H26N4O/c1-28-21-9-7-18(8-10-21)13-20-14-19-16-25-22(15-24)26-23(19)27(20)12-11-17-5-3-2-4-6-17/h7-10,14,16-17H,2-6,11-13H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252503
(6-(4-chlorobenzyl)-7-(2-cyclohexylethyl)-7H-pyrrol...)Show InChI InChI=1S/C22H23ClN4/c23-19-8-6-17(7-9-19)12-20-13-18-15-25-21(14-24)26-22(18)27(20)11-10-16-4-2-1-3-5-16/h6-9,13,15-16H,1-5,10-12H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 320 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252501
(6-(4-chlorobenzyl)-7-(4,4-dimethylpentyl)-7H-pyrro...)Show SMILES CC(C)(C)CCCn1c(Cc2ccc(Cl)cc2)cc2cnc(nc12)C#N Show InChI InChI=1S/C21H23ClN4/c1-21(2,3)9-4-10-26-18(11-15-5-7-17(22)8-6-15)12-16-14-24-19(13-23)25-20(16)26/h5-8,12,14H,4,9-11H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 320 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252502
(6-(4-chlorobenzyl)-7-(cyclohexylmethyl)-7H-pyrrolo...)Show InChI InChI=1S/C21H21ClN4/c22-18-8-6-15(7-9-18)10-19-11-17-13-24-20(12-23)25-21(17)26(19)14-16-4-2-1-3-5-16/h6-9,11,13,16H,1-5,10,14H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 370 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50251888
(3-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,3-d...)Show SMILES NC(=O)c1cccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)c1 Show InChI InChI=1S/C23H25N5O2/c24-13-21-26-14-18-11-19(15-30-20-8-4-7-17(12-20)22(25)29)28(23(18)27-21)10-9-16-5-2-1-3-6-16/h4,7-8,11-12,14,16H,1-3,5-6,9-10,15H2,(H2,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 390 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252599
(7-(2-cyclohexylethyl)-6-(naphthalen-1-ylmethyl)-7H...)Show SMILES N#Cc1ncc2cc(Cc3cccc4ccccc34)n(CCC3CCCCC3)c2n1 Show InChI InChI=1S/C26H26N4/c27-17-25-28-18-22-16-23(15-21-11-6-10-20-9-4-5-12-24(20)21)30(26(22)29-25)14-13-19-7-2-1-3-8-19/h4-6,9-12,16,18-19H,1-3,7-8,13-15H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 440 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50223938
(6-(4-chlorobenzyl)-7-neopentyl-7H-pyrrolo[2,3-d]py...)Show InChI InChI=1S/C19H19ClN4/c1-19(2,3)12-24-16(8-13-4-6-15(20)7-5-13)9-14-11-22-17(10-21)23-18(14)24/h4-7,9,11H,8,12H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 460 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252656
(7-(2-cyclohexylethyl)-6-((pyridin-4-yloxy)methyl)-...)Show InChI InChI=1S/C21H23N5S/c22-13-20-24-14-17-12-18(15-27-19-6-9-23-10-7-19)26(21(17)25-20)11-8-16-4-2-1-3-5-16/h6-7,9-10,12,14,16H,1-5,8,11,15H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 480 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252655
(7-(2-cyclohexylethyl)-6-((pyridin-2-yloxy)methyl)-...)Show InChI InChI=1S/C21H23N5O/c22-13-19-24-14-17-12-18(15-27-20-8-4-5-10-23-20)26(21(17)25-19)11-9-16-6-2-1-3-7-16/h4-5,8,10,12,14,16H,1-3,6-7,9,11,15H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 790 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252544
(6-(4-chlorobenzyl)-7-(2-cycloheptylethyl)-7H-pyrro...)Show InChI InChI=1S/C23H25ClN4/c24-20-9-7-18(8-10-20)13-21-14-19-16-26-22(15-25)27-23(19)28(21)12-11-17-5-3-1-2-4-6-17/h7-10,14,16-17H,1-6,11-13H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 840 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252501
(6-(4-chlorobenzyl)-7-(4,4-dimethylpentyl)-7H-pyrro...)Show SMILES CC(C)(C)CCCn1c(Cc2ccc(Cl)cc2)cc2cnc(nc12)C#N Show InChI InChI=1S/C21H23ClN4/c1-21(2,3)9-4-10-26-18(11-15-5-7-17(22)8-6-15)12-16-14-24-19(13-23)25-20(16)26/h5-8,12,14H,4,9-11H2,1-3H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252038
(6-((4-(1-acetyl-1,2,3,6-tetrahydropyridin-4-yl)phe...)Show SMILES CC(=O)N1CCC(=CC1)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 |c:6| Show InChI InChI=1S/C29H33N5O2/c1-21(35)33-14-12-24(13-15-33)23-7-9-27(10-8-23)36-20-26-17-25-19-31-28(18-30)32-29(25)34(26)16-11-22-5-3-2-4-6-22/h7-10,12,17,19,22H,2-6,11,13-16,20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252037
(6-((4-(1-acetylpiperidin-4-yl)phenoxy)methyl)-7-(2...)Show SMILES CC(=O)N1CCC(CC1)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C29H35N5O2/c1-21(35)33-14-12-24(13-15-33)23-7-9-27(10-8-23)36-20-26-17-25-19-31-28(18-30)32-29(25)34(26)16-11-22-5-3-2-4-6-22/h7-10,17,19,22,24H,2-6,11-16,20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252544
(6-(4-chlorobenzyl)-7-(2-cycloheptylethyl)-7H-pyrro...)Show InChI InChI=1S/C23H25ClN4/c24-20-9-7-18(8-10-20)13-21-14-19-16-26-22(15-25)27-23(19)28(21)12-11-17-5-3-1-2-4-6-17/h7-10,14,16-17H,1-6,11-13H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252600
(7-(2-cyclohexylethyl)-6-(cyclohexylmethyl)-7H-pyrr...)Show InChI InChI=1S/C22H30N4/c23-15-21-24-16-19-14-20(13-18-9-5-2-6-10-18)26(22(19)25-21)12-11-17-7-3-1-4-8-17/h14,16-18H,1-13H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50252597
(6-(4-chlorobenzyl)-7-(2-(piperidin-1-yl)ethyl)-7H-...)Show InChI InChI=1S/C21H22ClN5/c22-18-6-4-16(5-7-18)12-19-13-17-15-24-20(14-23)25-21(17)27(19)11-10-26-8-2-1-3-9-26/h4-7,13,15H,1-3,8-12H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin S by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252597
(6-(4-chlorobenzyl)-7-(2-(piperidin-1-yl)ethyl)-7H-...)Show InChI InChI=1S/C21H22ClN5/c22-18-6-4-16(5-7-18)12-19-13-17-15-24-20(14-23)25-21(17)27(19)11-10-26-8-2-1-3-9-26/h4-7,13,15H,1-3,8-12H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50251888
(3-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,3-d...)Show SMILES NC(=O)c1cccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)c1 Show InChI InChI=1S/C23H25N5O2/c24-13-21-26-14-18-11-19(15-30-20-8-4-7-17(12-20)22(25)29)28(23(18)27-21)10-9-16-5-2-1-3-6-16/h4,7-8,11-12,14,16H,1-3,5-6,9-10,15H2,(H2,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252504
(6-(4-chlorobenzyl)-7-(3-cyclohexylpropyl)-7H-pyrro...)Show InChI InChI=1S/C23H25ClN4/c24-20-10-8-18(9-11-20)13-21-14-19-16-26-22(15-25)27-23(19)28(21)12-4-7-17-5-2-1-3-6-17/h8-11,14,16-17H,1-7,12-13H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50251942
(CHEMBL520427 | N-(4-((2-cyano-7-(2-cyclohexylethyl...)Show SMILES CC(=O)Nc1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C24H27N5O2/c1-17(30)27-20-7-9-22(10-8-20)31-16-21-13-19-15-26-23(14-25)28-24(19)29(21)12-11-18-5-3-2-4-6-18/h7-10,13,15,18H,2-6,11-12,16H2,1H3,(H,27,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252596
(7-(3-chlorophenethyl)-6-(4-chlorobenzyl)-7H-pyrrol...)Show SMILES Clc1ccc(Cc2cc3cnc(nc3n2CCc2cccc(Cl)c2)C#N)cc1 Show InChI InChI=1S/C22H16Cl2N4/c23-18-6-4-16(5-7-18)11-20-12-17-14-26-21(13-25)27-22(17)28(20)9-8-15-2-1-3-19(24)10-15/h1-7,10,12,14H,8-9,11H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252545
(6-(4-chlorobenzyl)-7-(2-cyclooctylethyl)-7H-pyrrol...)Show SMILES Clc1ccc(Cc2cc3cnc(nc3n2CCC2CCCCCCC2)C#N)cc1 Show InChI InChI=1S/C24H27ClN4/c25-21-10-8-19(9-11-21)14-22-15-20-17-27-23(16-26)28-24(20)29(22)13-12-18-6-4-2-1-3-5-7-18/h8-11,15,17-18H,1-7,12-14H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252598
(6-(4-methoxybenzyl)-7-(2-cyclohexylethyl)-7H-pyrro...)Show InChI InChI=1S/C23H26N4O/c1-28-21-9-7-18(8-10-21)13-20-14-19-16-25-22(15-24)26-23(19)27(20)12-11-17-5-3-2-4-6-17/h7-10,14,16-17H,2-6,11-13H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252597
(6-(4-chlorobenzyl)-7-(2-(piperidin-1-yl)ethyl)-7H-...)Show InChI InChI=1S/C21H22ClN5/c22-18-6-4-16(5-7-18)12-19-13-17-15-24-20(14-23)25-21(17)27(19)11-10-26-8-2-1-3-9-26/h4-7,13,15H,1-3,8-12H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252653
(7-(2-cyclohexylethyl)-6-((methyl(phenyl)amino)meth...)Show InChI InChI=1S/C23H27N5/c1-27(20-10-6-3-7-11-20)17-21-14-19-16-25-22(15-24)26-23(19)28(21)13-12-18-8-4-2-5-9-18/h3,6-7,10-11,14,16,18H,2,4-5,8-9,12-13,17H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252652
(7-(2-cyclohexylethyl)-6-((phenylamino)methyl)-7H-p...)Show InChI InChI=1S/C22H25N5/c23-14-21-25-15-18-13-20(16-24-19-9-5-2-6-10-19)27(22(18)26-21)12-11-17-7-3-1-4-8-17/h2,5-6,9-10,13,15,17,24H,1,3-4,7-8,11-12,16H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252038
(6-((4-(1-acetyl-1,2,3,6-tetrahydropyridin-4-yl)phe...)Show SMILES CC(=O)N1CCC(=CC1)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 |c:6| Show InChI InChI=1S/C29H33N5O2/c1-21(35)33-14-12-24(13-15-33)23-7-9-27(10-8-23)36-20-26-17-25-19-31-28(18-30)32-29(25)34(26)16-11-22-5-3-2-4-6-22/h7-10,12,17,19,22H,2-6,11,13-16,20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252656
(7-(2-cyclohexylethyl)-6-((pyridin-4-yloxy)methyl)-...)Show InChI InChI=1S/C21H23N5S/c22-13-20-24-14-17-12-18(15-27-19-6-9-23-10-7-19)26(21(17)25-20)11-8-16-4-2-1-3-5-16/h6-7,9-10,12,14,16H,1-5,8,11,15H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252654
(7-(2-cyclohexylethyl)-6-(phenoxymethyl)-7H-pyrrolo...)Show InChI InChI=1S/C22H24N4O/c23-14-21-24-15-18-13-19(16-27-20-9-5-2-6-10-20)26(22(18)25-21)12-11-17-7-3-1-4-8-17/h2,5-6,9-10,13,15,17H,1,3-4,7-8,11-12,16H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252545
(6-(4-chlorobenzyl)-7-(2-cyclooctylethyl)-7H-pyrrol...)Show SMILES Clc1ccc(Cc2cc3cnc(nc3n2CCC2CCCCCCC2)C#N)cc1 Show InChI InChI=1S/C24H27ClN4/c25-21-10-8-19(9-11-21)14-22-15-20-17-27-23(16-26)28-24(20)29(22)13-12-18-6-4-2-1-3-5-7-18/h8-11,15,17-18H,1-7,12-14H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252037
(6-((4-(1-acetylpiperidin-4-yl)phenoxy)methyl)-7-(2...)Show SMILES CC(=O)N1CCC(CC1)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C29H35N5O2/c1-21(35)33-14-12-24(13-15-33)23-7-9-27(10-8-23)36-20-26-17-25-19-31-28(18-30)32-29(25)34(26)16-11-22-5-3-2-4-6-22/h7-10,17,19,22,24H,2-6,11-16,20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50251942
(CHEMBL520427 | N-(4-((2-cyano-7-(2-cyclohexylethyl...)Show SMILES CC(=O)Nc1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C24H27N5O2/c1-17(30)27-20-7-9-22(10-8-20)31-16-21-13-19-15-26-23(14-25)28-24(19)29(21)12-11-18-5-3-2-4-6-18/h7-10,13,15,18H,2-6,11-12,16H2,1H3,(H,27,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50251889
(4-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,3-d...)Show SMILES NC(=O)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C23H25N5O2/c24-13-21-26-14-18-12-19(15-30-20-8-6-17(7-9-20)22(25)29)28(23(18)27-21)11-10-16-4-2-1-3-5-16/h6-9,12,14,16H,1-5,10-11,15H2,(H2,25,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252652
(7-(2-cyclohexylethyl)-6-((phenylamino)methyl)-7H-p...)Show InChI InChI=1S/C22H25N5/c23-14-21-25-15-18-13-20(16-24-19-9-5-2-6-10-19)27(22(18)26-21)12-11-17-7-3-1-4-8-17/h2,5-6,9-10,13,15,17,24H,1,3-4,7-8,11-12,16H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252654
(7-(2-cyclohexylethyl)-6-(phenoxymethyl)-7H-pyrrolo...)Show InChI InChI=1S/C22H24N4O/c23-14-21-24-15-18-13-19(16-27-20-9-5-2-6-10-20)26(22(18)25-21)12-11-17-7-3-1-4-8-17/h2,5-6,9-10,13,15,17H,1,3-4,7-8,11-12,16H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252547
(6-(4-chlorobenzyl)-7-(4-chlorophenethyl)-7H-pyrrol...)Show SMILES Clc1ccc(CCn2c(Cc3ccc(Cl)cc3)cc3cnc(nc23)C#N)cc1 Show InChI InChI=1S/C22H16Cl2N4/c23-18-5-1-15(2-6-18)9-10-28-20(11-16-3-7-19(24)8-4-16)12-17-14-26-21(13-25)27-22(17)28/h1-8,12,14H,9-11H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252504
(6-(4-chlorobenzyl)-7-(3-cyclohexylpropyl)-7H-pyrro...)Show InChI InChI=1S/C23H25ClN4/c24-20-10-8-18(9-11-20)13-21-14-19-16-26-22(15-25)27-23(19)28(21)12-4-7-17-5-2-1-3-6-17/h8-11,14,16-17H,1-7,12-13H2 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252653
(7-(2-cyclohexylethyl)-6-((methyl(phenyl)amino)meth...)Show InChI InChI=1S/C23H27N5/c1-27(20-10-6-3-7-11-20)17-21-14-19-16-25-22(15-24)26-23(19)28(21)13-12-18-8-4-2-5-9-18/h3,6-7,10-11,14,16,18H,2,4-5,8-9,12-13,17H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50252036
(CHEMBL481169 | N-(4-((2-cyano-7-(2-cyclohexylethyl...)Show SMILES CCC(=O)Nc1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C25H29N5O2/c1-2-24(31)28-20-8-10-22(11-9-20)32-17-21-14-19-16-27-23(15-26)29-25(19)30(21)13-12-18-6-4-3-5-7-18/h8-11,14,16,18H,2-7,12-13,17H2,1H3,(H,28,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM25134
(2-cyano-pyrropyrimidine, 2 | 7-(2-cyclohexylethyl)...)Show SMILES CC(=O)N1CCN(CC1)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C28H34N6O2/c1-21(35)32-13-15-33(16-14-32)24-7-9-26(10-8-24)36-20-25-17-23-19-30-27(18-29)31-28(23)34(25)12-11-22-5-3-2-4-6-22/h7-10,17,19,22H,2-6,11-16,20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50251886
(4-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,3-d...)Show SMILES OC(=O)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C23H24N4O3/c24-13-21-25-14-18-12-19(15-30-20-8-6-17(7-9-20)23(28)29)27(22(18)26-21)11-10-16-4-2-1-3-5-16/h6-9,12,14,16H,1-5,10-11,15H2,(H,28,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50251886
(4-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,3-d...)Show SMILES OC(=O)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C23H24N4O3/c24-13-21-25-14-18-12-19(15-30-20-8-6-17(7-9-20)23(28)29)27(22(18)26-21)11-10-16-4-2-1-3-5-16/h6-9,12,14,16H,1-5,10-11,15H2,(H,28,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50252036
(CHEMBL481169 | N-(4-((2-cyano-7-(2-cyclohexylethyl...)Show SMILES CCC(=O)Nc1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C25H29N5O2/c1-2-24(31)28-20-8-10-22(11-9-20)32-17-21-14-19-16-27-23(15-26)29-25(19)30(21)13-12-18-6-4-3-5-7-18/h8-11,14,16,18H,2-7,12-13,17H2,1H3,(H,28,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM25134
(2-cyano-pyrropyrimidine, 2 | 7-(2-cyclohexylethyl)...)Show SMILES CC(=O)N1CCN(CC1)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)cc1 Show InChI InChI=1S/C28H34N6O2/c1-21(35)32-13-15-33(16-14-32)24-7-9-26(10-8-24)36-20-25-17-23-19-30-27(18-29)31-28(23)34(25)12-11-22-5-3-2-4-6-22/h7-10,17,19,22H,2-6,11-16,20H2,1H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Cathepsin K
(Homo sapiens (Human)) | BDBM50251887
(3-(3-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,...)Show SMILES OC(=O)CCc1cccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)c1 Show InChI InChI=1S/C25H28N4O3/c26-15-23-27-16-20-14-21(17-32-22-8-4-7-19(13-22)9-10-24(30)31)29(25(20)28-23)12-11-18-5-2-1-3-6-18/h4,7-8,13-14,16,18H,1-3,5-6,9-12,17H2,(H,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin K by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
Procathepsin L
(Homo sapiens (Human)) | BDBM50251887
(3-(3-((2-cyano-7-(2-cyclohexylethyl)-7H-pyrrolo[2,...)Show SMILES OC(=O)CCc1cccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)c1 Show InChI InChI=1S/C25H28N4O3/c26-15-23-27-16-20-14-21(17-32-22-8-4-7-19(13-22)9-10-24(30)31)29(25(20)28-23)12-11-18-5-2-1-3-6-18/h4,7-8,13-14,16,18H,1-3,5-6,9-12,17H2,(H,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institutes for BioMedical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant cathepsin L by fluorescence assay |
Bioorg Med Chem Lett 18: 3959-62 (2008)
Article DOI: 10.1016/j.bmcl.2008.06.009
BindingDB Entry DOI: 10.7270/Q23N235B |
More data for this
Ligand-Target Pair | |
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