BDBM50166312 1-[(3S,5S)-5-((S)-2-Cyano-pyrrolidine-1-carbonyl)-pyrrolidin-3-yl]-3-phenyl-urea::CHEMBL371585

SMILES: O=C(N[C@@H]1CN[C@@H](C1)C(=O)N1CCC[C@H]1C#N)Nc1ccccc1

InChI Key: InChIKey=HXXGZMZPSFVWAF-KKUMJFAQSA-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 = 50166312   

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 IV (Rattus norvegicus (rat))	BDBM50166312 (1-[(3S,5S)-5-((S)-2-Cyano-pyrrolidine-1-carbonyl)-...) Show SMILES O=C(N[C@@H]1CN[C@@H](C1)C(=O)N1CCC[C@H]1C#N)Nc1ccccc1 Show InChI InChI=1S/C17H21N5O2/c18-10-14-7-4-8-22(14)16(23)15-9-13(11-19-15)21-17(24)20-12-5-2-1-3-6-12/h1-3,5-6,13-15,19H,4,7-9,11H2,(H2,20,21,24)/t13-,14-,15-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Mitsubishi Pharma Corporation Curated by ChEMBL					Assay Description Inhibitory concentration against rat dipeptidyl-peptidase IV				Bioorg Med Chem Lett 15: 2441-5 (2005) Article DOI: 10.1016/j.bmcl.2005.03.077 BindingDB Entry DOI: 10.7270/Q27P8XWJ
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50166312 (1-[(3S,5S)-5-((S)-2-Cyano-pyrrolidine-1-carbonyl)-...) Show SMILES O=C(N[C@@H]1CN[C@@H](C1)C(=O)N1CCC[C@H]1C#N)Nc1ccccc1 Show InChI InChI=1S/C17H21N5O2/c18-10-14-7-4-8-22(14)16(23)15-9-13(11-19-15)21-17(24)20-12-5-2-1-3-6-12/h1-3,5-6,13-15,19H,4,7-9,11H2,(H2,20,21,24)/t13-,14-,15-/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	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Mitsubishi Pharma Corporation Curated by ChEMBL					Assay Description Inhibitory concentration against human dipeptidyl-peptidase IV				Bioorg Med Chem Lett 15: 2441-5 (2005) Article DOI: 10.1016/j.bmcl.2005.03.077 BindingDB Entry DOI: 10.7270/Q27P8XWJ
					More data for this Ligand-Target Pair