BDBM50016718 1-{3-Hydroxy-2-[(pyrrolidine-2-carbonyl)-amino]-propionyl}-pyrrolidine-2-carboxylic acid (1-carbamoyl-2-hydroxy-ethyl)-amide::CHEMBL81786

SMILES: NC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H]1CCCN1

InChI Key: InChIKey=VNBNJBIXMBHFQM-NOOOWODRSA-N

Data: 1 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 1 hit for monomerid = 50016718   

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
IgA protease (Neisseria gonorrhoeae)	BDBM50016718 (1-{3-Hydroxy-2-[(pyrrolidine-2-carbonyl)-amino]-pr...) Show SMILES NC(=O)[C@H](CO)NC(=O)[C@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H]1CCCN1 Show InChI InChI=1S/C16H27N5O6/c17-13(24)10(7-22)19-15(26)12-4-2-6-21(12)16(27)11(8-23)20-14(25)9-3-1-5-18-9/h9-12,18,22-23H,1-8H2,(H2,17,24)(H,19,26)(H,20,25)/t9-,10+,11+,12-/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University Hospital Curated by ChEMBL					Assay Description Inhibitory concentration against type 1 IgA1 proteinases secreted by Neisseria gonorrhoeae				J Med Chem 32: 2407-11 (1989) BindingDB Entry DOI: 10.7270/Q2R210B0
					More data for this Ligand-Target Pair