BDBM331540 N-((S)-2-((3aS,6S,6aS)-6-chloro-3-oxotetrahydro-2H-furo[3,2-b]pyrrol-4(5H)-yl)-1-cyclohexyl-2-oxoethyl)-5-(pyridin-4-yl)thiophene-2-carboxamide (3)::US9725459, 3
SMILES: O[C@H]1CO[C@@H]2[C@@H](Cl)CN([C@H]12)C(=O)[C@@H](NC(=O)c1ccc(s1)-c1ccncc1)C1CCCCC1
InChI Key: InChIKey=UDGAMABNKKQXCJ-ZBWQPJPKSA-N
Data: 2 KI
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cathepsin K (Homo sapiens (Human)) | BDBM331540 (N-((S)-2-((3aS,6S,6aS)-6-chloro-3-oxotetrahydro-2H...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GRUNENTHAL GMBH US Patent | Assay Description Recombinant human cathepsins (CatS, CatK, CatL) were purchased from a Enzo Life Sciences. All assays were carried out in 96-well format using a buffe... | US Patent US9725459 (2017) BindingDB Entry DOI: 10.7270/Q2JH3P8R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cathepsin S (Homo sapiens (Human)) | BDBM331540 (N-((S)-2-((3aS,6S,6aS)-6-chloro-3-oxotetrahydro-2H...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | 103 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
GRUNENTHAL GMBH US Patent | Assay Description Recombinant human cathepsins (CatS, CatK, CatL) were purchased from a Enzo Life Sciences. All assays were carried out in 96-well format using a buffe... | US Patent US9725459 (2017) BindingDB Entry DOI: 10.7270/Q2JH3P8R | |||||||||||
More data for this Ligand-Target Pair |