On Target NA_A-H3N8 0.22310758/CHEMBL222813
For the given ligand Molnupiravir, we have found in our database that, being scored 0.22310758, the most similar ligand is CHEMBL222813. Check out the elaboration below.
| Molnupiravir (Given Ligand) | CHEMBL222813 (Similar Ligand) |
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| CC(C)C(=O)OC[C@H]2O[C@@H](n1ccc(=NO)[nH]c1=O)[C@H](O)[C@@H]2O | CC(=O)N[C@@H]1[C@@H](NC(=N)N)C=C(C(=O)O)O[C@H]1[C@H](O)[C@H](O)CO |
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| 00000042 01400000 80001588 81010700 003800e0 00004140 00000400 80000044 05006302 818000b0 0400004c 40019014 00009000 03c80110 00281080 001ed01c 10a20000 01000000 19c00000 00001801 80884020 10000a10 27800045 4c200010 10020400 40008002 40000380 10000070 000c0200 0346000a 40280000 00000084 | 00000000 8904f200 00100101 84010d01 003c00c1 00200200 00080180 38802c08 01000600 011000ca 80200000 4001c000 8002b002 01892000 02001408 391b9008 30210814 80000540 51c16010 00002201 00000020 70152fb0 17008080 0a10001c 00021403 88008c00 40c04000 90000121 0800c250 00040401 ac0e0000 00004a00 |