On Target OPRM_HUMAN 0.37662336/CHEMBL228687
For the given ligand Aprepitant, we have found in our database that, being scored 0.37662336, the most similar ligand is CHEMBL228687. Check out the elaboration below.
| Aprepitant (Given Ligand) | CHEMBL228687 (Similar Ligand) |
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| 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 | CCOCC(N1CCC(O)(CC1)c2ccccc2)c3ccccc3 |
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| 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 | 00000000 01000200 00100100 80010600 000000c0 00004000 00000000 22001040 00000900 000808c0 08300000 50018000 00000802 00000000 000c1408 000c0008 18000000 02000000 04800000 00000201 00010120 18008020 13000080 00500010 00000401 c0000000 00000000 90000001 00000300 0006000a 60040000 00000600 |