On Target OPRK_HUMAN 0.503268/CHEMBL4112000
For the given ligand Captagon, we have found in our database that, being scored 0.503268, the most similar ligand is CHEMBL4112000. Check out the elaboration below.
| Captagon (Given Ligand) | CHEMBL4112000 (Similar Ligand) |
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| CC(Cc1ccccc1)NCCn2cnc3c2c(=O)n(C)c(=O)n3C | CC(C)C[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](N)Cc2ccccc2)C(=O)N[C@H](CCCCN)C(=O)N3CCC(CC3)N4C(=O)Nc5ccccc45 |
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| 0000002a 00801c00 00180100 42010700 00180040 0000c080 00008000 00000000 06600980 800808e0 0c30900c 40008000 00009002 01400000 00280880 000c000c 00800000 02088000 00400000 00000201 80000100 38200040 21800041 83700014 00040000 c0200000 60000000 00040000 0c004000 00460012 c0080000 00000e80 | 00010002 01003600 00100100 04010600 000c0040 00004080 00000000 2000000c 04200980 800809e0 0d30800c 5001b000 0600900a 01c42001 803000c0 000c0004 00100000 02000000 00602008 00000201 c0000100 382c0630 21800003 83700018 00000800 c0000000 00000000 10000000 0c000000 0046001b 60084000 00002680 |