On Target NOS1_HUMAN 0.3229572/CHEMBL3217000
For the given ligand 94, we have found in our database that, being scored 0.3229572, the most similar ligand is CHEMBL3217000. Check out the elaboration below.
| 94 (Given Ligand) | CHEMBL3217000 (Similar Ligand) |
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| COc1ccccc1NC(=O)CSc3nnc(Cc2cccn2C)n3CCc4ccccc4 | Cl.Cl.CCOc1ccc(Cc2nc3cc(NC(=N)c4cccs4)ccc3n2CCN(C)C)cc1 |
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| 0000400e 00304308 70100928 10118e02 810b1020 00080004 06800100 2c003200 00060510 125c4cc0 0928810c 42818900 00008006 00140000 01020441 000c640c 04048000 02000007 88600000 00260a41 40300000 1e818600 21b02000 81488410 22000000 c0000201 20204040 d00100c0 04208204 0006004b a6000280 22210654 | 0401400a 00800018 22100508 50090600 001c1060 00084000 02048080 02001200 10200100 100818c3 0920920c 4081c080 00881812 01400020 01022cc1 020c008c 0004d000 03000009 08600000 0002020c c0121000 780480b0 21810001 00400410 0a000000 c4000002 40120080 80000084 0804831c 00460812 62080000 24c30ec0 |