On Target AA2BR_HUMAN 0.3939394/CHEMBL3317576
For the given ligand MITRAGYNINE, we have found in our database that, being scored 0.3939394, the most similar ligand is CHEMBL3317576. Check out the elaboration below.
| MITRAGYNINE (Given Ligand) | CHEMBL3317576 (Similar Ligand) |
|---|---|
| CCC4CN3CCc1c([nH]c2cccc(OC)c12)C3CC4/C(=C\OC)C(=O)OC | COc1cccc(CCCc2nc(N)c3nn(cc3n2)c4ccccc4)c1 |
|
|
|
|
|
|
| 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 | 0000000e c3800208 2008150a 18090620 01081060 4000c000 07009010 00001800 10100900 000d18c0 09108004 40819000 00000802 20a00000 010200c1 020c000c 10000000 06000008 01680008 00260601 c0000100 18018060 25800840 83400010 00100000 80000000 08010000 00000880 0400020c 00c6080a 40040000 a02405e0 |