Found 2 hits in this display 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)) | BDBM50114027
(CHEMBL3605414)Show SMILES Fc1cc(ccc1NC(=O)N1CCCCC1)C(=O)NC1(CCCCC1)C(=O)NCC#N Show InChI InChI=1S/C22H28FN5O3/c23-17-15-16(7-8-18(17)26-21(31)28-13-5-2-6-14-28)19(29)27-22(9-3-1-4-10-22)20(30)25-12-11-24/h7-8,15H,1-6,9-10,12-14H2,(H,25,30)(H,26,31)(H,27,29) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 55 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Chemistry
Curated by ChEMBL
| Assay Description Inhibition of human cathepsin-K using Z-Gly-Pro-Arg-AMC as substrate preincubated for 30 mins measured after 10 mins by fluorescence assay |
J Med Chem 58: 6928-37 (2015)
Article DOI: 10.1021/acs.jmedchem.5b00746 BindingDB Entry DOI: 10.7270/Q2BK1F44 |
More data for this Ligand-Target Pair | |
Cathepsin S
(Homo sapiens (Human)) | BDBM50114027
(CHEMBL3605414)Show SMILES Fc1cc(ccc1NC(=O)N1CCCCC1)C(=O)NC1(CCCCC1)C(=O)NCC#N Show InChI InChI=1S/C22H28FN5O3/c23-17-15-16(7-8-18(17)26-21(31)28-13-5-2-6-14-28)19(29)27-22(9-3-1-4-10-22)20(30)25-12-11-24/h7-8,15H,1-6,9-10,12-14H2,(H,25,30)(H,26,31)(H,27,29) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute of Chemistry
Curated by ChEMBL
| Assay Description Inhibition of human cathepsin-S using Z-Phe-Val-Arg-AMC as substrate preincubated for 30 mins measured after 10 mins by fluorescence assay |
J Med Chem 58: 6928-37 (2015)
Article DOI: 10.1021/acs.jmedchem.5b00746 BindingDB Entry DOI: 10.7270/Q2BK1F44 |
More data for this Ligand-Target Pair | |