On Target IKKB_HUMAN 0.38418078/CHEMBL230185
For the given ligand Upadacitinib, we have found in our database that, being scored 0.38418078, the most similar ligand is CHEMBL230185. Check out the elaboration below.
| Upadacitinib (Given Ligand) | CHEMBL230185 (Similar Ligand) |
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| CC[C@@H]1CN(C(=O)NCC(F)(F)F)C[C@@H]1c3cnc4cnc2[nH]ccc2n34 | Cc1cnc2c(NCCN3CCCCC3)nc3cc4ccccc4cc3n12 |
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| 0c00000a 01801000 00100422 11800e10 04080360 0000e010 0100b024 2000200c 10400981 00090280 21208004 40810800 00009802 00500800 018e0000 000c0004 08000008 0e000000 00600448 40000201 60000d00 18258440 21800040 10300018 04051000 80000200 08008000 90000184 04000004 00c60809 400c0200 20002680 | 0000000a 01000000 00100000 14000630 00040060 0800c020 00008000 20000000 10400100 20000ac0 01208004 50018800 00000802 00502000 008e0041 021c0004 08000000 02004000 00200000 40a00201 40100000 7e008028 21800801 02300012 00040002 01100000 08008400 1000008c 0800001c 00461800 40041000 00000280 |