On Target GASR_HUMAN 0.50627613/CHEMBL293026
For the given ligand MITRAGYNINE, we have found in our database that, being scored 0.50627613, the most similar ligand is CHEMBL293026. Check out the elaboration below.
| MITRAGYNINE (Given Ligand) | CHEMBL293026 (Similar Ligand) |
|---|---|
| CCC4CN3CCc1c([nH]c2cccc(OC)c12)C3CC4/C(=C\OC)C(=O)OC | CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c3cc4cc(O)ccc4[nH]3)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc5ccccc5)C(=O)N |
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| 0001000a 4300c808 2010010a 51010f10 000c1020 80100002 070c2000 22003409 11400880 003908c0 08318004 50819000 9400889e 21e08000 03020461 020c010c 00824201 06000026 006c2418 00060201 40120100 18218a18 21804000 91500010 00142000 c0002001 08325000 90000080 04004306 00860002 24068200 20246630 | 00070002 0140ba08 20100100 55810e10 00141220 00118000 06002000 2200300d 00c00a80 000908c0 08390004 4001b000 1e00880e 00502801 80020440 021e010c 00020000 02080007 00e02c18 00020201 40000100 38378e38 21802083 9350001c 00143801 c0000002 08000000 90200020 0c000306 0006000b a0044200 00806e20 |