Showing 1 to 20 of 20 entries Per page:
Compound ID
Cluster
Compound Type
Target/Cell Structure Activity Assay Description Source
Type
Relation
Value
Unit
NAs.000038 2 all-match Adenosine A1 receptor NAs.000038 Ki = 14000.0 nM Binding affinity towards adenosine A1 receptor in rat brain cortex CHEMBL1134790
NAs.000038 2 all-match No relevant target NAs.000038 Other None 0.79 None ASTRAZENECA: Octan-1-ol/water (pH7.4) distribution coefficent measured by a shake flask method described in J. Biomol. Screen. 2011, 16, 348-355. Experimental range -1.5 to 4.5 CHEMBL3301361
NAs.000038 2 all-match Unchecked NAs.000038 IC50 = 510.0 nM Inhibition of Haemophilus influenzae LigA CHEMBL3098126
NAs.000038 2 all-match DNA ligase NAs.000038 IC50 = 430.0 nM Inhibition of Staphylococcus aureus LigA CHEMBL3098126
NAs.000038 2 all-match Unchecked NAs.000038 IC50 None None None Inhibition of Enterococcus faecalis LigA CHEMBL3098126
NAs.000038 2 all-match Unchecked NAs.000038 IC50 = 210.0 nM Inhibition of wild type Streptococcus pneumoniae LigA CHEMBL3098126
NAs.000038 2 all-match Streptococcus pneumoniae NAs.000038 Other = 8.0 ug.mL-1 Antibacterial activity against Streptococcus pneumoniae ARC548 CHEMBL3098126
NAs.000038 2 all-match Unchecked NAs.000038 IC50 = 33000.0 nM Inhibition of Streptococcus pneumoniae LigA L75F mutant CHEMBL3098126
NAs.000038 2 all-match Caco-2 NAs.000038 Other = 0.28 10'-6 cm/s Apparent permeability from apical to basolateral side in human Caco2 cells CHEMBL1806435
NAs.000038 2 all-match Plasma NAs.000038 Other = 0.66 None Plasma protein binding in human assessed as fraction unbound by by equilibrium dialysis method CHEMBL1806435
NAs.000038 2 all-match No relevant target NAs.000038 Other > 1000000.0 nM Equilibrium solubility of the compound CHEMBL1806435
NAs.000038 2 all-match No relevant target NAs.000038 Other = 0.79 None Lipophilicity, log D of the compound in octanol buffer at pH 7.4 by shake flask method CHEMBL1806435
NAs.000038 2 all-match Streptococcus pneumoniae NAs.000038 Other = 16.0 ug.mL-1 Antibacterial activity against Streptococcus pneumoniae CHEMBL1806435
NAs.000038 2 all-match Unchecked NAs.000038 IC50 = 150.0 nM Inhibition of Streptococcus pneumoniae LigA by FRET-based assay CHEMBL1806435
NAs.000038 2 all-match Unchecked NAs.000038 IC50 = 430.0 nM Inhibition of Staphylococcus aureus LigA by FRET-based assay CHEMBL1806435
NAs.000038 2 all-match Adenosine A2a receptor NAs.000038 Ki = 1000.0 nM Binding affinity towards adenosine A2A receptor in rat brain striatum CHEMBL1134790
NAs.000038 2 all-match Staphylococcus aureus NAs.000038 Other = 64.0 ug.mL-1 Antibacterial activity against Staphylococcus aureus CHEMBL1806435
NAs.002106 2 all-match Adenosine A2 receptor NAs.002106 EC50 = 91.2 nM Coronary arteries vasodilation at the Adenosine A2 receptor in langendorff guinea pig heart preparation CHEMBL1125661
NAs.002106 2 all-match Adenosine A1 receptor NAs.002106 EC50 = 79432.82 nM Prolongation of the stimulus-QRS interval by 50% of the maximum response at the Adenosine A1 receptor in langendorff guinea pig heart preparation CHEMBL1125661
NAs.002106 2 all-match Adenosine receptors; A1 & A2 NAs.002106 Other = 890.0 None Ratio of EC50 stim-QRS (conduction block) and EC50 for vasodilation of coronary arteries CHEMBL1125661