BDBM352414 N—((S)-2-((3aS,6S,6aS)-6-chloro-3-oxotetrahydro-2H-furo[3,2-b]pyrrol-4(5H)-yl)-1-cyclopentyl-2-oxoethyl)-5-(pyridin-3-yl)thiophene-2-carboxamide::US9802947, Compound Example 2

SMILES: O[C@H]1CO[C@@H]2[C@@H](Cl)CN([C@H]12)C(=O)[C@@H](NC(=O)c1ccc(s1)-c1cccnc1)C1CCCC1

InChI Key: InChIKey=AQQFLUKPFDHDKF-WPCMGHOJSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 352414   

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))	BDBM352414 (N—((S)-2-((3aS,6S,6aS)-6-chloro-3-oxotetrahydro-2H...) Show SMILES O[C@H]1CO[C@@H]2[C@@H](Cl)CN([C@H]12)C(=O)[C@@H](NC(=O)c1ccc(s1)-c1cccnc1)C1CCCC1 |r| Show InChI InChI=1S/C23H26ClN3O4S/c24-15-11-27(20-16(28)12-31-21(15)20)23(30)19(13-4-1-2-5-13)26-22(29)18-8-7-17(32-18)14-6-3-9-25-10-14/h3,6-10,13,15-16,19-21,28H,1-2,4-5,11-12H2,(H,26,29)/t15-,16-,19-,20+,21+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GRÜNENTHAL GMBH US Patent					Assay Description Recombinant human cathepsins (CatS, CatK, CatL, CatB) were purchased from a Enzo Life Sciences. All assays were carried out in 96-well format using a...				US Patent US9802947 (2017) BindingDB Entry DOI: 10.7270/Q2HX1FT3
					More data for this Ligand-Target Pair
Cathepsin S (Homo sapiens (Human))	BDBM352414 (N—((S)-2-((3aS,6S,6aS)-6-chloro-3-oxotetrahydro-2H...) Show SMILES O[C@H]1CO[C@@H]2[C@@H](Cl)CN([C@H]12)C(=O)[C@@H](NC(=O)c1ccc(s1)-c1cccnc1)C1CCCC1 |r| Show InChI InChI=1S/C23H26ClN3O4S/c24-15-11-27(20-16(28)12-31-21(15)20)23(30)19(13-4-1-2-5-13)26-22(29)18-8-7-17(32-18)14-6-3-9-25-10-14/h3,6-10,13,15-16,19-21,28H,1-2,4-5,11-12H2,(H,26,29)/t15-,16-,19-,20+,21+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	308	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GRÜNENTHAL GMBH US Patent					Assay Description Recombinant human cathepsins (CatS, CatK, CatL, CatB) were purchased from a Enzo Life Sciences. All assays were carried out in 96-well format using a...				US Patent US9802947 (2017) BindingDB Entry DOI: 10.7270/Q2HX1FT3
					More data for this Ligand-Target Pair