Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 413.4 BDBM474360

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 ()	BDBM474360 (3-((R)-(3-fluorophenyl)((S)-11-hydroxy-10- oxo-5,6...) Show SMILES Oc1c2-c3nccn3C[C@H]([C@@H](c3cccc(F)c3)c3cccc(c3)C#N)n2ncc1=O |r| Show InChI InChI=1S/C23H16FN5O2/c24-17-6-2-5-16(10-17)20(15-4-1-3-14(9-15)11-25)18-13-28-8-7-26-23(28)21-22(31)19(30)12-27-29(18)21/h1-10,12,18,20,31H,13H2/t18-,20-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	50	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 ()	BDBM474360 (3-((R)-(3-fluorophenyl)((S)-11-hydroxy-10- oxo-5,6...) Show SMILES Oc1c2-c3nccn3C[C@H]([C@@H](c3cccc(F)c3)c3cccc(c3)C#N)n2ncc1=O |r| Show InChI InChI=1S/C23H16FN5O2/c24-17-6-2-5-16(10-17)20(15-4-1-3-14(9-15)11-25)18-13-28-8-7-26-23(28)21-22(31)19(30)12-27-29(18)21/h1-10,12,18,20,31H,13H2/t18-,20-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	50	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