On Target MTOR_HUMAN 0.31578946/CHEMBL3910225
For the given ligand aprepitant, we have found in our database that, being scored 0.31578946, the most similar ligand is CHEMBL3910225. Check out the elaboration below.
| aprepitant (Given Ligand) | CHEMBL3910225 (Similar Ligand) |
|---|---|
| C[C@@H](O[C@H]2OCCN(Cc1nc(=O)[nH][nH]1)[C@H]2c3ccc(F)cc3)c4cc(C(F)(F)F)cc(C(F)(F)F)c4 | CCOc1c(CN2CCOCC2)nc(nc1N3CCOCC3)c4ccc(NC(=O)Nc5ccccc5)cc4 |
|
|
|
|
|
|
| 00000018 000d0008 40100100 82010e00 090000d1 00104014 00801c00 0a003441 04200900 00180870 0c211020 44008802 00008802 01011000 00261408 0228210c 18008040 02000182 04400000 40300000 00010020 08008030 33000000 00400010 10000400 c0002400 00080000 b4020001 00008306 00068002 c4540084 02002600 | 1401001e 00000828 c0003100 980d0e40 810000a0 0c104106 00c09000 08083c41 10800100 10100850 082d2004 40049800 04009002 08108001 0102144c 000c610c 10040808 0200e022 88400000 00600000 40100140 0804a400 32c26040 00408110 00144c00 c0000600 28000200 800010a1 0000830c 00660401 44009800 000042e0 |