On Target NK1R_HUMAN 0.5030675/CHEMBL2114439
For the given ligand sinomenine, we have found in our database that, being scored 0.5030675, the most similar ligand is CHEMBL2114439. Check out the elaboration below.
| sinomenine (Given Ligand) | CHEMBL2114439 (Similar Ligand) |
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| CO/C4=C/C2C3Cc1ccc(OC)c(O)c1[C@]2(CCN3C)CC4=O | COc1ccccc1CN[C@H]1C2CCNC1(c1ccccc1)CC=C2C |
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| 00010000 4b000208 2010010a 00110700 00081020 c0000002 070c0180 20000603 01000880 001888ca 08300000 5181d040 8402c01a 20a00000 03000421 020ca008 20800200 82000060 00492008 00020201 00000100 18200290 0100c000 81540010 00200800 80002001 04524000 90000180 04004202 0006c40a 2c020000 00012600 | 00000000 09000008 2010010a 04110600 00001000 00000100 02080000 22001402 10200880 001908ca 08300000 51038000 00020802 00202000 01000401 00002008 00004000 02000060 00002000 00020201 00000100 38208010 00008001 83500010 00200000 c0002000 00404000 90000000 0c000302 00060402 24060000 00012600 |