On Target ACM5_HUMAN 0.46875/CHEMBL106219
For the given ligand MITRAGYNINE, we have found in our database that, being scored 0.46875, the most similar ligand is CHEMBL106219. Check out the elaboration below.
| MITRAGYNINE (Given Ligand) | CHEMBL106219 (Similar Ligand) |
|---|---|
| CCC4CN3CCc1c([nH]c2cccc(OC)c12)C3CC4/C(=C\OC)C(=O)OC | CCOC(=O)c1c(CC)n(Cc2ccccc2)c3ccc4OC5N(CCc6cc(OC)ccc56)Cc4c13 |
|
|
|
|
|
|
| 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 | 0400000a 4280da08 60100109 90010610 00041030 8000c500 161c0000 22021404 94500380 10180cc0 48208004 40818800 808088a6 2061a000 01020441 0a1e200c 00022209 82888024 00290002 40030200 c0020840 18268a78 20804000 81d0341c 00046400 c0012222 086a4040 90000000 04400305 0006004a e40c8204 20000620 |