ID: | t881 | |
---|---|---|
Name: | Digoxin | |
Description: | ||
Labels: | ||
CAS: | 20830-75-5 | |
InChi Code: | InChI=1S/C41H64O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h12,19-21,23-31,33-38,42-45,47-48H,6-11,13-18H2,1-5H3 |
er_ago: Activity in ER agonist pathway
Value | Source or prediction |
---|---|
inactive |
experimental value |
inactive |
Tab3.agonists: Model for ER activity on agonists pathway (Test set) |
er_ant: Activity in ER antagonist pathway
Value | Source or prediction |
---|---|
inactive |
experimental value |
antagonist |
Tab3.antagonists: Model for ER activity on antagonists pathway (Test set) |
er_bin: Binding activity in estrogen receptor
Value | Source or prediction |
---|---|
inactive |
experimental value |
binder |
Tab3.binders: Model for binding in ER (Test set) |