On Target CXCR2_HUMAN 0.40833333/CHEMBL404088
For the given ligand MITRAGYNINE, we have found in our database that, being scored 0.40833333, the most similar ligand is CHEMBL404088. Check out the elaboration below.
| MITRAGYNINE (Given Ligand) | CHEMBL404088 (Similar Ligand) |
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| CCC4CN3CCc1c([nH]c2cccc(OC)c12)C3CC4/C(=C\OC)C(=O)OC | COc1cc2[nH]c(c(CCCC(=O)NS(=O)(=O)C)c2cc1C#N)c3ccc(F)cc3 |
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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 | 00012006 01000809 2010010a 53b10610 01861121 00000010 06002000 00081008 00500900 10c808c0 08102004 40819800 0c008802 00609801 a1420061 0204200c 02420000 02002004 04a00400 00564203 40000100 18008608 30804400 90400010 02842000 80000001 08000440 0000004d 00404304 00068422 00040a00 00650670 |