BDBM33251 phthalazine-based compound, 2
SMILES: C1CN=C(N1)c1ccc(Nc2nnc(Nc3ccc(cc3)-c3ccccc3)c3ccccc23)cc1
InChI Key: InChIKey=BTZWYGLEDWVKKG-UHFFFAOYSA-N
Data: 5 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Dengue Virus 1 (DENV1) NS2B-NS3 Protease (Dengue virus 1(Hawaii)) | BDBM33251 (phthalazine-based compound, 2) | PDB MMDB B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Novartis Institute for Tropical Diseases | Assay Description Inhibitors were assayed in a 96-well plate format. Typically, protease was preincubated with concentrations of test compounds at 37 deg C for 30 min.... | Anal Biochem 395: 195-204 (2009) Article DOI: 10.1016/j.ab.2009.08.013 BindingDB Entry DOI: 10.7270/Q2VM49MW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dengue Virus 2 (DENV2) NS2B-NS3 Protease (Dengue virus 2 (strain TSV01)) | BDBM33251 (phthalazine-based compound, 2) | PDB MMDB B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Novartis Institute for Tropical Diseases | Assay Description Inhibitors were assayed in a 96-well plate format. Typically, protease was preincubated with concentrations of test compounds at 37 deg C for 30 min.... | Anal Biochem 395: 195-204 (2009) Article DOI: 10.1016/j.ab.2009.08.013 BindingDB Entry DOI: 10.7270/Q2VM49MW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dengue Virus 4 (DENV4) NS2B-NS3 Protease (Dengue virus 4 (H241)) | BDBM33251 (phthalazine-based compound, 2) | MMDB GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for Tropical Diseases | Assay Description Inhibitors were assayed in a 96-well plate format. Typically, protease was preincubated with concentrations of test compounds at 37 deg C for 30 min.... | Anal Biochem 395: 195-204 (2009) Article DOI: 10.1016/j.ab.2009.08.013 BindingDB Entry DOI: 10.7270/Q2VM49MW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dengue Virus 3 (DENV3) NS2B-NS3 Protease (Dengue virus 3 (strain S221/03)) | BDBM33251 (phthalazine-based compound, 2) | PDB B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Institute for Tropical Diseases | Assay Description Inhibitors were assayed in a 96-well plate format. Typically, protease was preincubated with concentrations of test compounds at 37 deg C for 30 min.... | Anal Biochem 395: 195-204 (2009) Article DOI: 10.1016/j.ab.2009.08.013 BindingDB Entry DOI: 10.7270/Q2VM49MW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
West Nile Virus (WNV) NS2B-NS3 Protease (West Nile virus (WNV)) | BDBM33251 (phthalazine-based compound, 2) | PDB MMDB B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 3.60E+3 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Novartis Institute for Tropical Diseases | Assay Description Inhibitors were assayed in a 96-well plate format. Typically, protease was preincubated with concentrations of test compounds at 37 deg C for 30 min.... | Anal Biochem 395: 195-204 (2009) Article DOI: 10.1016/j.ab.2009.08.013 BindingDB Entry DOI: 10.7270/Q2VM49MW | |||||||||||
More data for this Ligand-Target Pair |