On Target MDR1_HUMAN 0.47142857/CHEMBL45068
For the given ligand Fenbufen, we have found in our database that, being scored 0.47142857, the most similar ligand is CHEMBL45068. Check out the elaboration below.
| Fenbufen (Given Ligand) | CHEMBL45068 (Similar Ligand) |
|---|---|
| O=C(O)CCC(=O)c2ccc(c1ccccc1)cc2 | Oc1ccc(CCC(=O)c2c(O)cc(O)cc2O)cc1 |
|
|
|
|
|
|
| 00052000 01000800 00000102 40010200 00080000 00000000 00000000 00000000 00000900 00080840 08100000 40009800 04008000 00200000 00000000 00080008 00020000 02000000 04400000 10000001 00000100 08020a00 11000000 00400014 00000000 80000000 00000000 00000040 00004002 00020002 80000000 00400400 | 00000001 01000808 20000103 00010200 00000000 00020000 02000000 00000200 00000800 00080840 08100000 40009040 04008002 00200000 00000000 00022008 00000000 02000000 00000008 00020801 00000100 08020200 00000000 00400014 00000800 80000000 00120000 00000000 00000000 00024002 80000000 00000400 |