Compile Data Set for Download or QSAR

Found 6 hits of ic50 data for polymerid = 50007182   

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
Yersiniabactin biosynthetic protein (Yersinia pestis)	BDBM50339905 (5'-O-(N-(L-CYSTEINYL)-SULFAMOYL)ADENOSINE | 5'-O-[...) Show SMILES N[C@@H](CS)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r| Show InChI InChI=1S/C13H19N7O7S2/c14-5(2-28)12(23)19-29(24,25)26-1-6-8(21)9(22)13(27-6)20-4-18-7-10(15)16-3-17-11(7)20/h3-6,8-9,13,21-22,28H,1-2,14H2,(H,19,23)(H2,15,16,17)/t5-,6+,8+,9+,13+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Weill Cornell Graduate School of Medical Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant Yersinia pestis C-terminal His6-tagged HMWP2 cysteine adenylation domain (1 to 1491 residues) expressed in Escherichia coli...				Bioorg Med Chem Lett 26: 5340-5345 (2016) Article DOI: 10.1016/j.bmcl.2016.09.027 BindingDB Entry DOI: 10.7270/Q2CZ394B
					More data for this Ligand-Target Pair
Yersiniabactin biosynthetic protein (Yersinia pestis)	BDBM50197294 (CHEMBL3897138) Show SMILES N[C@H]1CCCc2nc3c(N)ncnc3n2[C@@H]2O[C@H](COS(=O)(=O)NC1=O)[C@@H](O)[C@H]2O |r| Show InChI InChI=1S/C15H21N7O7S/c16-6-2-1-3-8-20-9-12(17)18-5-19-13(9)22(8)15-11(24)10(23)7(29-15)4-28-30(26,27)21-14(6)25/h5-7,10-11,15,23-24H,1-4,16H2,(H,21,25)(H2,17,18,19)/t6-,7+,10+,11+,15+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
Weill Cornell Graduate School of Medical Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant Yersinia pestis C-terminal His6-tagged HMWP2 cysteine adenylation domain (1 to 1491 residues) expressed in Escherichia coli...				Bioorg Med Chem Lett 26: 5340-5345 (2016) Article DOI: 10.1016/j.bmcl.2016.09.027 BindingDB Entry DOI: 10.7270/Q2CZ394B
					More data for this Ligand-Target Pair
Yersiniabactin biosynthetic protein (Yersinia pestis)	BDBM50197291 (AlaSA) Show SMILES C[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r| Show InChI InChI=1S/C13H19N7O7S/c1-5(14)12(23)19-28(24,25)26-2-6-8(21)9(22)13(27-6)20-4-18-7-10(15)16-3-17-11(7)20/h3-6,8-9,13,21-22H,2,14H2,1H3,(H,19,23)(H2,15,16,17)/t5-,6+,8+,9+,13+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
Weill Cornell Graduate School of Medical Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant Yersinia pestis C-terminal His6-tagged HMWP2 cysteine adenylation domain (1 to 1491 residues) expressed in Escherichia coli...				Bioorg Med Chem Lett 26: 5340-5345 (2016) Article DOI: 10.1016/j.bmcl.2016.09.027 BindingDB Entry DOI: 10.7270/Q2CZ394B
					More data for this Ligand-Target Pair
Yersiniabactin biosynthetic protein (Yersinia pestis)	BDBM50197295 (CHEMBL3934723) Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COS(=O)(=O)NC(=O)[C@@H](O)CS)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C13H18N6O8S2/c14-10-7-11(16-3-15-10)19(4-17-7)13-9(22)8(21)6(27-13)1-26-29(24,25)18-12(23)5(20)2-28/h3-6,8-9,13,20-22,28H,1-2H2,(H,18,23)(H2,14,15,16)/t5-,6+,8+,9+,13+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.65E+4	n/a	n/a	n/a	n/a	n/a	n/a
Weill Cornell Graduate School of Medical Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant Yersinia pestis C-terminal His6-tagged HMWP2 cysteine adenylation domain (1 to 1491 residues) expressed in Escherichia coli...				Bioorg Med Chem Lett 26: 5340-5345 (2016) Article DOI: 10.1016/j.bmcl.2016.09.027 BindingDB Entry DOI: 10.7270/Q2CZ394B
					More data for this Ligand-Target Pair
Yersiniabactin biosynthetic protein (Yersinia pestis)	BDBM50197292 (CHEMBL3889888) Show SMILES C[C@H](O)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r| Show InChI InChI=1S/C13H18N6O8S/c1-5(20)12(23)18-28(24,25)26-2-6-8(21)9(22)13(27-6)19-4-17-7-10(14)15-3-16-11(7)19/h3-6,8-9,13,20-22H,2H2,1H3,(H,18,23)(H2,14,15,16)/t5-,6+,8+,9+,13+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Weill Cornell Graduate School of Medical Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant Yersinia pestis C-terminal His6-tagged HMWP2 cysteine adenylation domain (1 to 1491 residues) expressed in Escherichia coli...				Bioorg Med Chem Lett 26: 5340-5345 (2016) Article DOI: 10.1016/j.bmcl.2016.09.027 BindingDB Entry DOI: 10.7270/Q2CZ394B
					More data for this Ligand-Target Pair
Yersiniabactin biosynthetic protein (Yersinia pestis)	BDBM50197293 (CHEMBL3968275) Show SMILES Nc1ncnc2n3[C@@H]4O[C@H](COS(=O)(=O)NC(=O)[C@@H](O)CCCc3nc12)[C@@H](O)[C@H]4O |r| Show InChI InChI=1S/C15H20N6O8S/c16-12-9-13(18-5-17-12)21-8(19-9)3-1-2-6(22)14(25)20-30(26,27)28-4-7-10(23)11(24)15(21)29-7/h5-7,10-11,15,22-24H,1-4H2,(H,20,25)(H2,16,17,18)/t6-,7+,10+,11+,15+/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Weill Cornell Graduate School of Medical Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant Yersinia pestis C-terminal His6-tagged HMWP2 cysteine adenylation domain (1 to 1491 residues) expressed in Escherichia coli...				Bioorg Med Chem Lett 26: 5340-5345 (2016) Article DOI: 10.1016/j.bmcl.2016.09.027 BindingDB Entry DOI: 10.7270/Q2CZ394B
					More data for this Ligand-Target Pair