On Target ACM3_HUMAN 0.37012988/CHEMBL1201335
For the given ligand test1, we have found in our database that, being scored 0.37012988, the most similar ligand is CHEMBL1201335. Check out the elaboration below.
| test1 (Given Ligand) | CHEMBL1201335 (Similar Ligand) |
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| CC6(C)O[C@H]1CC(=O)OC[C@]17[C@H]5CC[C@@]4(C)[C@H](c2ccoc2)OC(=O)[C@H]3O[C@]34[C@]5(C)C(=O)C[C@@H]67 | C[N+]1(C)CCC(C1)OC(=O)C(O)(C2CCCC2)c3ccccc3 |
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| 00050040 81200008 80080102 00014300 802c00d1 00200000 00004000 00200040 000a6900 010a0040 04180000 4008d000 54008428 02b10000 00080000 5a089008 08820020 82050100 13402000 00002001 00000020 18000a00 05000040 08080014 00000400 80004000 00080410 0a800031 60000202 0002000a 40020000 02000400 | 00010040 01000000 00100302 80010700 000800c0 00004010 00000000 00000040 00000900 000808c0 08300000 4000d000 0500800a 00a80000 40041008 00099008 18a60000 02000000 04c02000 00000001 00010120 18000a20 17000080 08400010 10000400 80000000 00000000 10000021 00000202 01060006 40022000 00000600 |