BDBM50310704 CHEMBL1078356::Cis-(2S,4S)-N-(2-benzyl-1-cyanocyclopropyl)-4-fluoropyrrolidine-2-carboxamide

SMILES: F[C@@H]1CN[C@@H](C1)C(=O)NC1(CC1Cc1ccccc1)C#N

InChI Key: InChIKey=YUWXKYWHTIMUMG-WJEHIRDRSA-N

Data: 2 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 2 hits for monomerid = 50310704   

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
Dipeptidyl peptidase I (Homo sapiens (Human))	BDBM50310704 (CHEMBL1078356 | Cis-(2S,4S)-N-(2-benzyl-1-cyanocyc...) Show SMILES F[C@@H]1CN[C@@H](C1)C(=O)NC1(CC1Cc1ccccc1)C#N |r| Show InChI InChI=1S/C16H18FN3O/c17-13-7-14(19-9-13)15(21)20-16(10-18)8-12(16)6-11-4-2-1-3-5-11/h1-5,12-14,19H,6-9H2,(H,20,21)/t12?,13-,14-,16?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Canada& Co. Curated by ChEMBL					Assay Description Inhibition of human recombinant cathepsin C				Bioorg Med Chem Lett 19: 5392-6 (2009) Article DOI: 10.1016/j.bmcl.2009.07.114 BindingDB Entry DOI: 10.7270/Q298874W
					More data for this Ligand-Target Pair
Dipeptidyl peptidase I (Homo sapiens (Human))	BDBM50310704 (CHEMBL1078356 | Cis-(2S,4S)-N-(2-benzyl-1-cyanocyc...) Show SMILES F[C@@H]1CN[C@@H](C1)C(=O)NC1(CC1Cc1ccccc1)C#N |r| Show InChI InChI=1S/C16H18FN3O/c17-13-7-14(19-9-13)15(21)20-16(10-18)8-12(16)6-11-4-2-1-3-5-11/h1-5,12-14,19H,6-9H2,(H,20,21)/t12?,13-,14-,16?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Canada& Co. Curated by ChEMBL					Assay Description Inhibition of human recombinant cathepsin C				Bioorg Med Chem Lett 19: 5392-6 (2009) Article DOI: 10.1016/j.bmcl.2009.07.114 BindingDB Entry DOI: 10.7270/Q298874W
					More data for this Ligand-Target Pair