On Target CALCR_HUMAN 0.33707866/CHEMBL2369897
For the given ligand MITRAGYNINE, we have found in our database that, being scored 0.33707866, the most similar ligand is CHEMBL2369897. Check out the elaboration below.
| MITRAGYNINE (Given Ligand) | CHEMBL2369897 (Similar Ligand) |
|---|---|
| CCC4CN3CCc1c([nH]c2cccc(OC)c12)C3CC4/C(=C\OC)C(=O)OC | CCCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N)NC(=O)CNC(=O)[C@@H](N)CS)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)[C@H](Cc3ccccc3)NC(=O)C(Cc4c[nH]cn4)N[C@@H](CCC)C(=O)N[C@@H](Cc5ccc(O)cc5)C(=O)N6CCC[C@@H]6C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N7CCC[C@@H]7C(=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 | 04070002 01007608 20100102 05910610 041002c0 00000010 02002020 2000000c 00700980 020f0be0 2830a000 5003b800 1e00801a 00342801 811a0000 000c000c 10000000 0e000001 00c02018 40420301 60000d00 383c0e30 23000283 97500018 00041801 80000200 00120000 10000100 0c000006 0046003b 60024000 23812e00 |