On Target MSHR_HUMAN 0.50214595/CHEMBL3421678
For the given ligand MITRAGYNINE, we have found in our database that, being scored 0.50214595, the most similar ligand is CHEMBL3421678. Check out the elaboration below.
| MITRAGYNINE (Given Ligand) | CHEMBL3421678 (Similar Ligand) |
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| CCC4CN3CCc1c([nH]c2cccc(OC)c12)C3CC4/C(=C\OC)C(=O)OC | CC(=O)N[C@H]1Cc2c(CN([C@H](Cc3ccc(Br)cc3)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc4c[nH]c5ccccc45)C(=O)N)C1=O)[nH]c6ccccc26 |
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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 | 0001c00a 0180ba00 00100100 55810e10 00041220 00100000 01002000 2200300d 00600a80 000908c2 08310004 4003b000 1e009892 0060a801 800204c0 02140104 00000200 02000406 00200408 00000a01 c0020100 38278628 20804003 93500018 00143880 c0000001 48124000 90000000 0c000114 0186000b a00c4208 08006620 |