On Target CASP1_HUMAN 0.30555555/CHEMBL25864
For the given ligand 94, we have found in our database that, being scored 0.30555555, the most similar ligand is CHEMBL25864. Check out the elaboration below.
| 94 (Given Ligand) | CHEMBL25864 (Similar Ligand) |
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| COc1ccccc1NC(=O)CSc3nnc(Cc2cccn2C)n3CCc4ccccc4 | OC(=O)C[C@H](NC(=O)CN1C(=CC=C(NC(=O)c2cccc3ccccc23)C1=O)Cc4ccccc4)C(=O)COc5ccccc5 |
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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 | 0405400a 01801c08 20104108 50050720 040c1024 0a086040 02000800 03001000 06200001 500808e0 0c2c800c 4081f000 0e888822 02708001 11120d81 060c208c 04a44040 c2000009 08e00010 00221207 c0100000 38128e18 21816081 0270041e 0c801003 e1100000 00000458 c0000080 08040b86 00460013 a0244000 200016c8 |