Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'IgA-specific serine endopeptidase autotransporter' and Ligand = 'BDBM50367757'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
IgA-specific serine endopeptidase autotransporter (Neisseria gonorrhoeae)	BDBM50367757 (CHEMBL2369560) Show SMILES C[C@@H](O)[C@H](NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(O)=O Show InChI InChI=1S/C36H56N8O14/c1-18(47)27(37-20(3)49)34(55)44-15-7-11-26(44)33(54)42-13-5-10-25(42)31(52)40-28(19(2)48)35(56)43-14-6-9-24(43)29(50)38-21(16-45)32(53)41-12-4-8-23(41)30(51)39-22(17-46)36(57)58/h18-19,21-28,45-48H,4-17H2,1-3H3,(H,37,49)(H,38,50)(H,39,51)(H,40,52)(H,57,58)/t18-,19+,21+,22+,23+,24+,25+,26+,27+,28+/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.57E+6	n/a	n/a	n/a	n/a	n/a	n/a
University Hospital Curated by ChEMBL					Assay Description Tested for inhibitory activity against IgA1 proteinase				J Med Chem 31: 1647-51 (1988) BindingDB Entry DOI: 10.7270/Q2S46SKJ
					More data for this Ligand-Target Pair
IgA-specific serine endopeptidase autotransporter (Neisseria gonorrhoeae)	BDBM50367757 (CHEMBL2369560) Show SMILES C[C@@H](O)[C@H](NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(O)=O Show InChI InChI=1S/C36H56N8O14/c1-18(47)27(37-20(3)49)34(55)44-15-7-11-26(44)33(54)42-13-5-10-25(42)31(52)40-28(19(2)48)35(56)43-14-6-9-24(43)29(50)38-21(16-45)32(53)41-12-4-8-23(41)30(51)39-22(17-46)36(57)58/h18-19,21-28,45-48H,4-17H2,1-3H3,(H,37,49)(H,38,50)(H,39,51)(H,40,52)(H,57,58)/t18-,19+,21+,22+,23+,24+,25+,26+,27+,28+/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.57E+6	n/a	n/a	n/a	n/a	n/a	n/a
University Hospital Curated by ChEMBL					Assay Description Tested for inhibitory activity against IgA1 proteinase				J Med Chem 31: 1647-51 (1988) BindingDB Entry DOI: 10.7270/Q2S46SKJ
					More data for this Ligand-Target Pair