On Target E2AK2_HUMAN 0.3837838/CHEMBL2171124
For the given ligand Tofacitinib, we have found in our database that, being scored 0.3837838, the most similar ligand is CHEMBL2171124. Check out the elaboration below.
| Tofacitinib (Given Ligand) | CHEMBL2171124 (Similar Ligand) |
|---|---|
| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | Cn1cc(-c2ccc3c(c2)CCN3C(=O)Cc2cccc(C(F)(F)F)c2)c2c(N)ncnc21 |
|
|
|
|
|
|
| 00014006 01803800 00180020 0c080600 20080000 00086000 00008000 20100808 00200100 00000280 00200004 50031000 04008802 00002000 00020000 101c0004 00440000 00004008 08600000 00200205 40100000 3a048660 60804441 0210001e 00000000 80000000 00008000 10000080 08000018 004e0001 c0001200 000026c0 | 00006002 00811800 00180100 080d0610 20081001 0400e048 00008400 00000804 00000180 000808d0 0828002c 60019002 01008802 01908000 400201c0 900c000e 00068000 82801008 0c600000 40280200 c0100000 18228660 31802040 8140001d 00040001 80080080 08008210 900050c1 0409c008 00460003 c0102200 200026e0 |