On Target CCKAR_HUMAN 0.503937/CHEMBL2372623
For the given ligand MITRAGYNINE, we have found in our database that, being scored 0.503937, the most similar ligand is CHEMBL2372623. Check out the elaboration below.
| MITRAGYNINE (Given Ligand) | CHEMBL2372623 (Similar Ligand) |
|---|---|
| CCC4CN3CCc1c([nH]c2cccc(OC)c12)C3CC4/C(=C\OC)C(=O)OC | CCCC[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc3ccc4ccccc4c3)NC(=O)[C@H](Cc5cnc[nH]5)NC(=O)[C@@H]6Cc7ccccc7CN6C(=O)[C@@H](N)Cc8c(C)cc(O)cc8C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc9ccccc9)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 | 0407800a 41803a08 20100100 55810e10 04141261 00000000 03002020 2200300c 00600b80 00090ac2 28308004 5003b800 1e00989a 00702801 810204c0 021c000c 00000200 0e000021 00e02418 40020201 e0020d00 38358e38 21804083 93500018 00043801 c0000201 48124000 90000100 0c000116 00c6000b e00c4200 20802e20 |