Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM50137744'   

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
Genome polyprotein (Human rhinovirus B)	BDBM50137744 (CHEMBL328740 | {(S)-1-[(1S,3aR,6aS)-4,4-Difluoro-1...) Show SMILES CCCC(NC(=O)[C@@H]1[C@H]2CCC(F)(F)[C@H]2CN1C(=O)[C@@H](NC(=O)OC(C)C)C(C)(C)C)C(=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C30H42F2N4O6/c1-7-11-21(23(37)26(39)33-18-12-9-8-10-13-18)34-25(38)22-19-14-15-30(31,32)20(19)16-36(22)27(40)24(29(4,5)6)35-28(41)42-17(2)3/h8-10,12-13,17,19-22,24H,7,11,14-16H2,1-6H3,(H,33,39)(H,34,38)(H,35,41)/t19-,20-,21?,22-,24+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	270	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratory Curated by ChEMBL					Assay Description Binding affinity towards Protease using PNA assay in rats				Bioorg Med Chem Lett 14: 263-6 (2003) BindingDB Entry DOI: 10.7270/Q2VX0FX5
					More data for this Ligand-Target Pair
Genome polyprotein (Human rhinovirus B)	BDBM50137744 (CHEMBL328740 | {(S)-1-[(1S,3aR,6aS)-4,4-Difluoro-1...) Show SMILES CCCC(NC(=O)[C@@H]1[C@H]2CCC(F)(F)[C@H]2CN1C(=O)[C@@H](NC(=O)OC(C)C)C(C)(C)C)C(=O)C(=O)Nc1ccccc1 Show InChI InChI=1S/C30H42F2N4O6/c1-7-11-21(23(37)26(39)33-18-12-9-8-10-13-18)34-25(38)22-19-14-15-30(31,32)20(19)16-36(22)27(40)24(29(4,5)6)35-28(41)42-17(2)3/h8-10,12-13,17,19-22,24H,7,11,14-16H2,1-6H3,(H,33,39)(H,34,38)(H,35,41)/t19-,20-,21?,22-,24+/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratory Curated by ChEMBL					Assay Description Inhibitory activity of the compound against Protease using replicon assay in rats at 50 microM concentration				Bioorg Med Chem Lett 14: 263-6 (2003) BindingDB Entry DOI: 10.7270/Q2VX0FX5
					More data for this Ligand-Target Pair