On Target CXCR1_HUMAN 0.3083004/CHEMBL3426944
For the given ligand 94, we have found in our database that, being scored 0.3083004, the most similar ligand is CHEMBL3426944. Check out the elaboration below.
| 94 (Given Ligand) | CHEMBL3426944 (Similar Ligand) |
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| COc1ccccc1NC(=O)CSc3nnc(Cc2cccn2C)n3CCc4ccccc4 | OB(O)c1ccc(OC(F)(F)F)cc1CSc2ccc(cn2)C(=O)Nc3ccc(F)cc3 |
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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 | 10004202 4180da08 201265aa 0231a611 01051010 00000010 02024100 02001004 00020000 00004841 01688004 6040c004 00009802 40151000 01201041 0004000c 14040008 03000105 08280020 00220200 e0100000 084c8e00 20812008 0068000d 00040000 d0008000 48018000 c0000081 02408314 00868005 90000000 80010260 |