Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 402.4 BDBM474358

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

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
Polymerase acidic protein ()	BDBM474358 ((S)-6-((S)-(4-fluorophenyl)(o-tolyl)methyl)-11- hy...) Show SMILES Cc1ccccc1[C@@H]([C@H]1Cn2ccnc2-c2c(O)c(=O)cnn12)c1ccc(F)cc1 |r| Show InChI InChI=1S/C23H19FN4O2/c1-14-4-2-3-5-17(14)20(15-6-8-16(24)9-7-15)18-13-27-11-10-25-23(27)21-22(30)19(29)12-26-28(18)21/h2-12,18,20,30H,13H2,1H3/t18-,20+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Compounds were dissolved and serially diluted in 100% DMSO then 0.5 μl was transferred to 384-well plates. 50 nM truncated Influenza A/victoria/...				Citation and Details BindingDB Entry DOI: 10.7270/Q2Z60S8G
					More data for this Ligand-Target Pair
Polymerase acidic protein ()	BDBM474358 ((S)-6-((S)-(4-fluorophenyl)(o-tolyl)methyl)-11- hy...) Show SMILES Cc1ccccc1[C@@H]([C@H]1Cn2ccnc2-c2c(O)c(=O)cnn12)c1ccc(F)cc1 |r| Show InChI InChI=1S/C23H19FN4O2/c1-14-4-2-3-5-17(14)20(15-6-8-16(24)9-7-15)18-13-27-11-10-25-23(27)21-22(30)19(29)12-26-28(18)21/h2-12,18,20,30H,13H2,1H3/t18-,20+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Novartis AG US Patent					Assay Description Compounds were dissolved and serially diluted in 100% DMSO then 0.5 μl was transferred to 384-well plates. 50 nM truncated Influenza A/victoria/...				US Patent US10858366 (2020) BindingDB Entry DOI: 10.7270/Q2KH0RDJ
					More data for this Ligand-Target Pair