On Target MSHR_HUMAN 0.3611111/CHEMBL180937
For the given ligand Captagon, we have found in our database that, being scored 0.3611111, the most similar ligand is CHEMBL180937. Check out the elaboration below.
| Captagon (Given Ligand) | CHEMBL180937 (Similar Ligand) |
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| CC(Cc1ccccc1)NCCn2cnc3c2c(=O)n(C)c(=O)n3C | Clc1ccc(C[C@@H](NC(=O)C2Cc3ccccc3CN2)C(=O)N4CCN(CC4)C5(Cn6cncn6)CCCC5)cc1 |
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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 | 0000800c 01003608 40100100 14010600 00180020 00008004 01000000 2200100c 00000980 000908c0 08301008 4001b800 06008826 00a02001 80000c80 020c000c 00008000 02000020 00c02008 00200201 80020100 382487d0 210040a3 83500018 00002801 c0000001 00044000 90000000 0c000100 0186001b a0044000 00022f00 |