BDBM50177771 4'-(4-tert-Butylamino-piperidin-1-yl)-biphenyl-4-carboxylic acid [1-(cyanomethyl-carbamoyl)-cyclohexyl]-amide::CHEMBL199163

SMILES: CC(C)(C)NC1CCN(CC1)c1ccc(cc1)-c1ccc(cc1)C(=O)NC1(CCCCC1)C(=O)NCC#N

InChI Key: InChIKey=QYEUDSXPORTFRD-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50177771   

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
Procathepsin L (Homo sapiens (Human))	BDBM50177771 (4'-(4-tert-Butylamino-piperidin-1-yl)-biphenyl-4-c...) Show SMILES CC(C)(C)NC1CCN(CC1)c1ccc(cc1)-c1ccc(cc1)C(=O)NC1(CCCCC1)C(=O)NCC#N Show InChI InChI=1S/C31H41N5O2/c1-30(2,3)34-26-15-21-36(22-16-26)27-13-11-24(12-14-27)23-7-9-25(10-8-23)28(37)35-31(17-5-4-6-18-31)29(38)33-20-19-32/h7-14,26,34H,4-6,15-18,20-22H2,1-3H3,(H,33,38)(H,35,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Celera Genomics, Inc. Curated by ChEMBL					Assay Description Inhibitory constant against human cathepsin L using Z-Phe-Arg-AMC substrate				J Med Chem 48: 7520-34 (2005) Article DOI: 10.1021/jm058198r BindingDB Entry DOI: 10.7270/Q23T9GSB
					More data for this Ligand-Target Pair
Cathepsin S (Homo sapiens (Human))	BDBM50177771 (4'-(4-tert-Butylamino-piperidin-1-yl)-biphenyl-4-c...) Show SMILES CC(C)(C)NC1CCN(CC1)c1ccc(cc1)-c1ccc(cc1)C(=O)NC1(CCCCC1)C(=O)NCC#N Show InChI InChI=1S/C31H41N5O2/c1-30(2,3)34-26-15-21-36(22-16-26)27-13-11-24(12-14-27)23-7-9-25(10-8-23)28(37)35-31(17-5-4-6-18-31)29(38)33-20-19-32/h7-14,26,34H,4-6,15-18,20-22H2,1-3H3,(H,33,38)(H,35,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Celera Genomics, Inc. Curated by ChEMBL					Assay Description Inhibitory constant against human cathepsin S using Z-Val-Val-Arg-AMC substrate				J Med Chem 48: 7520-34 (2005) Article DOI: 10.1021/jm058198r BindingDB Entry DOI: 10.7270/Q23T9GSB
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50177771 (4'-(4-tert-Butylamino-piperidin-1-yl)-biphenyl-4-c...) Show SMILES CC(C)(C)NC1CCN(CC1)c1ccc(cc1)-c1ccc(cc1)C(=O)NC1(CCCCC1)C(=O)NCC#N Show InChI InChI=1S/C31H41N5O2/c1-30(2,3)34-26-15-21-36(22-16-26)27-13-11-24(12-14-27)23-7-9-25(10-8-23)28(37)35-31(17-5-4-6-18-31)29(38)33-20-19-32/h7-14,26,34H,4-6,15-18,20-22H2,1-3H3,(H,33,38)(H,35,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Celera Genomics, Inc. Curated by ChEMBL					Assay Description Inhibitory constant against human cathepsin B using Boc-Leu-Lys-Arg-AMC substrate				J Med Chem 48: 7520-34 (2005) Article DOI: 10.1021/jm058198r BindingDB Entry DOI: 10.7270/Q23T9GSB
					More data for this Ligand-Target Pair