On Target CASP1_HUMAN 0.3882979/CHEMBL202025
For the given ligand ok, we have found in our database that, being scored 0.3882979, the most similar ligand is CHEMBL202025. Check out the elaboration below.
| ok (Given Ligand) | CHEMBL202025 (Similar Ligand) |
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| COc4ccc(c3cc1nccn1c(Nc2ccccc2C(N)=O)n3)cc4OC | OC(=O)C[C@H](NC(=O)c1ccc(CNC(=O)c2ccc(Nc3cnc4ccccc4n3)cc2)cc1)C=O |
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| 0000a20a 40800808 a0080108 08850600 01001044 0001c000 0204a000 00081800 00c00100 00000840 01208004 60009800 8600c832 00100000 01060041 080c800c 08060040 12006000 0cc90008 10a23200 40000000 4c02a640 b1806840 0040010c 00000000 80000000 00028000 000110e0 0000c20c 00461808 c0041800 400000a2 | 00048002 00811800 00100100 c0010620 00040040 08000000 00008010 02001000 00002100 00000840 00200004 4000b010 8e008802 00408000 00840440 000c000c 08042000 12005001 08e00012 10a00201 c0000000 5c128e00 21800880 0060001c 00001003 c0000000 00008400 80010088 0000810a 00461801 e0044000 00000280 |