BDBM50163832 (1S)-2-cyclohexyl-1-methylethyl (2S)-1-cyanopyrrolidine-2-carboxylate::(2S)-1-cyclohexylpropan-2-yl 1-cyanopyrrolidine-2-carboxylate::CHEMBL180839

SMILES: C[C@@H](CC1CCCCC1)OC(=O)C1CCCN1C#N

InChI Key: InChIKey=ITTAWEBSDKYKKK-NBFOIZRFSA-N

Data: 1 KI  4 IC50

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 5 hits for monomerid = 50163832   

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))	BDBM50163832 ((1S)-2-cyclohexyl-1-methylethyl (2S)-1-cyanopyrrol...) Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCCN1C#N Show InChI InChI=1S/C15H24N2O2/c1-12(10-13-6-3-2-4-7-13)19-15(18)14-8-5-9-17(14)11-16/h12-14H,2-10H2,1H3/t12-,14?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition constant against human cathepsin K				Bioorg Med Chem Lett 15: 3039-43 (2005) Article DOI: 10.1016/j.bmcl.2005.04.032 BindingDB Entry DOI: 10.7270/Q2MS3S8C
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50163832 ((1S)-2-cyclohexyl-1-methylethyl (2S)-1-cyanopyrrol...) Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCCN1C#N Show InChI InChI=1S/C15H24N2O2/c1-12(10-13-6-3-2-4-7-13)19-15(18)14-8-5-9-17(14)11-16/h12-14H,2-10H2,1H3/t12-,14?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibitory concentration against human cathepsin B using 10 uM Cbz-Phe-Arg-AMC				Bioorg Med Chem Lett 15: 1815-9 (2005) Article DOI: 10.1016/j.bmcl.2005.02.033 BindingDB Entry DOI: 10.7270/Q2DR2V1G
					More data for this Ligand-Target Pair
Cathepsin K (Homo sapiens (Human))	BDBM50163832 ((1S)-2-cyclohexyl-1-methylethyl (2S)-1-cyanopyrrol...) Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCCN1C#N Show InChI InChI=1S/C15H24N2O2/c1-12(10-13-6-3-2-4-7-13)19-15(18)14-8-5-9-17(14)11-16/h12-14H,2-10H2,1H3/t12-,14?/m0/s1	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	1.80	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibitory concentration against human cathepsin K using 10 uM Cbz-Phe-Arg-AMC				Bioorg Med Chem Lett 15: 1815-9 (2005) Article DOI: 10.1016/j.bmcl.2005.02.033 BindingDB Entry DOI: 10.7270/Q2DR2V1G
					More data for this Ligand-Target Pair
Pro-cathepsin H (Homo sapiens (Human))	BDBM50163832 ((1S)-2-cyclohexyl-1-methylethyl (2S)-1-cyanopyrrol...) Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCCN1C#N Show InChI InChI=1S/C15H24N2O2/c1-12(10-13-6-3-2-4-7-13)19-15(18)14-8-5-9-17(14)11-16/h12-14H,2-10H2,1H3/t12-,14?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibitory concentration against human cathepsin H using 50 uM L-Arg-beta-naphthalamide				Bioorg Med Chem Lett 15: 1815-9 (2005) Article DOI: 10.1016/j.bmcl.2005.02.033 BindingDB Entry DOI: 10.7270/Q2DR2V1G
					More data for this Ligand-Target Pair
Procathepsin L (Homo sapiens (Human))	BDBM50163832 ((1S)-2-cyclohexyl-1-methylethyl (2S)-1-cyanopyrrol...) Show SMILES C[C@@H](CC1CCCCC1)OC(=O)C1CCCN1C#N Show InChI InChI=1S/C15H24N2O2/c1-12(10-13-6-3-2-4-7-13)19-15(18)14-8-5-9-17(14)11-16/h12-14H,2-10H2,1H3/t12-,14?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibitory concentration against human cathepsin L using 5 uM Cbz-Phe-Arg-AMC				Bioorg Med Chem Lett 15: 1815-9 (2005) Article DOI: 10.1016/j.bmcl.2005.02.033 BindingDB Entry DOI: 10.7270/Q2DR2V1G
					More data for this Ligand-Target Pair