On Target AA1R_HUMAN 0.8211382/CHEMBL591235
For the given ligand Captagon, we have found in our database that, being scored 0.8211382, the most similar ligand is CHEMBL591235. Check out the elaboration below.
| Captagon (Given Ligand) | CHEMBL591235 (Similar Ligand) |
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| CC(Cc1ccccc1)NCCn2cnc3c2c(=O)n(C)c(=O)n3C | CCCN1C(=O)N(CCc2ccc(N)cc2)c3ncn(CCN(CC)CCO)c3C1=O |
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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 | 0000002a 00801e00 00080100 42010700 001800c0 0000c0c0 00008000 00000000 06700100 800808e0 0c20900c 40018000 00009002 01c00000 003808c0 000c100c 10800000 02088000 00400000 00000000 c0000100 38000050 23800041 83700014 02040000 c0200000 60000000 00040000 0c004000 0046001a c0080000 00000e80 |