BDBM50168272 (S)-1-[(S)-2-Amino-4-(4-benzoyl-piperazin-1-yl)-4-oxo-butyryl]-pyrrolidine-2-carbonitrile::CHEMBL190029

SMILES: N[C@@H](CC(=O)N1CCN(CC1)C(=O)c1ccccc1)C(=O)N1CCC[C@H]1C#N

InChI Key: InChIKey=SOYGWDUWIWWWAW-IRXDYDNUSA-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 = 50168272   

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 VIII (Homo sapiens (Human))	BDBM50168272 ((S)-1-[(S)-2-Amino-4-(4-benzoyl-piperazin-1-yl)-4-...) Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(=O)c1ccccc1)C(=O)N1CCC[C@H]1C#N Show InChI InChI=1S/C20H25N5O3/c21-14-16-7-4-8-25(16)20(28)17(22)13-18(26)23-9-11-24(12-10-23)19(27)15-5-2-1-3-6-15/h1-3,5-6,16-17H,4,7-13,22H2/t16-,17-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	71	n/a	n/a	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description Inhibitory concentration against Dipeptidyl-peptidase 8				Bioorg Med Chem Lett 15: 3271-5 (2005) Article DOI: 10.1016/j.bmcl.2005.04.051 BindingDB Entry DOI: 10.7270/Q2RF5TJX
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50168272 ((S)-1-[(S)-2-Amino-4-(4-benzoyl-piperazin-1-yl)-4-...) Show SMILES N[C@@H](CC(=O)N1CCN(CC1)C(=O)c1ccccc1)C(=O)N1CCC[C@H]1C#N Show InChI InChI=1S/C20H25N5O3/c21-14-16-7-4-8-25(16)20(28)17(22)13-18(26)23-9-11-24(12-10-23)19(27)15-5-2-1-3-6-15/h1-3,5-6,16-17H,4,7-13,22H2/t16-,17-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	123	n/a	n/a	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description Inhibitory concentration against Dipeptidyl-peptidase IV [DPP-IV]				Bioorg Med Chem Lett 15: 3271-5 (2005) Article DOI: 10.1016/j.bmcl.2005.04.051 BindingDB Entry DOI: 10.7270/Q2RF5TJX
					More data for this Ligand-Target Pair