Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 485.2 BDBM474357

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 ()	BDBM474357 ((S)-6-((R)-(2-bromo-4-fluorophenyl)(4- fluoropheny...) Show SMILES Oc1c2-c3nccn3C[C@H]([C@H](c3ccc(F)cc3)c3ccc(F)cc3Br)n2ncc1=O |r| Show InChI InChI=1S/C22H15BrF2N4O2/c23-16-9-14(25)5-6-15(16)19(12-1-3-13(24)4-2-12)17-11-28-8-7-26-22(28)20-21(31)18(30)10-27-29(17)20/h1-10,17,19,31H,11H2/t17-,19-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	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 ()	BDBM474357 ((S)-6-((R)-(2-bromo-4-fluorophenyl)(4- fluoropheny...) Show SMILES Oc1c2-c3nccn3C[C@H]([C@H](c3ccc(F)cc3)c3ccc(F)cc3Br)n2ncc1=O |r| Show InChI InChI=1S/C22H15BrF2N4O2/c23-16-9-14(25)5-6-15(16)19(12-1-3-13(24)4-2-12)17-11-28-8-7-26-22(28)20-21(31)18(30)10-27-29(17)20/h1-10,17,19,31H,11H2/t17-,19-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	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