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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'IgA-specific serine endopeptidase autotransporter' and Ligand = 'BDBM50016713'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
IgA-specific serine endopeptidase autotransporter


(Neisseria gonorrhoeae)		BDBM50016713
PNG
(3-Hydroxy-2-[(1-{3-hydroxy-2-[(pyrrolidine-2-carbo...)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H]1CCCN1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CO)C(O)=O
Show InChI InChI=1S/C17H28N4O7/c1-9(23)13(20-14(24)10-4-2-6-18-10)16(26)21-7-3-5-12(21)15(25)19-11(8-22)17(27)28/h9-13,18,22-23H,2-8H2,1H3,(H,19,25)(H,20,24)(H,27,28)/t9-,10-,11+,12-,13+/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/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