On Target COMT_HUMAN 0.2559055/CHEMBL3819488
For the given ligand Alfentanil, we have found in our database that, being scored 0.2559055, the most similar ligand is CHEMBL3819488. Check out the elaboration below.
| Alfentanil (Given Ligand) | CHEMBL3819488 (Similar Ligand) |
|---|---|
| CCC(=O)N(c1ccccc1)C3(COC)CCN(CCn2nnn(CC)c2=O)CC3 | CN(Cc1ccc(cc1)C(=O)c2cc(O)c(O)c(c2)[N+](=O)[O-])C(=O)CCCCCNC(=O)C[C@H](NC(=O)c3ccc(cc3)N=[N+]=[N-])C(=O)NCCCOCCOCCOCCCNC(=O)CCCC[C@@H]4SC[C@@H]5NC(=O)N[C@H]45 |
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| 00004002 01005418 40101000 00010700 20100080 00000008 08000000 20000000 04200001 000009e0 002c0004 50019000 0000800e 00500000 400a1e40 0008100c 10042000 00000800 08c00000 00040201 60160000 38080600 33002081 02300018 14044001 00000004 08800200 14000081 08008200 00060011 80000000 08002a00 | 08038002 c7803c18 20101101 c4110e40 00004000 00000000 02002004 23003048 14602300 020949e0 0c200004 4007b800 8e019a0e 000c2100 20100541 300ac018 04209000 02802001 00802070 00020701 c4020120 381f8610 25000393 0a72141c 00851403 e0000000 80124000 d000a020 88500382 00060033 a00e4000 27812600 |