On Target FAK1_HUMAN 0.4258373/CHEMBL3692192
For the given ligand Upadacitinib, we have found in our database that, being scored 0.4258373, the most similar ligand is CHEMBL3692192. Check out the elaboration below.
| Upadacitinib (Given Ligand) | CHEMBL3692192 (Similar Ligand) |
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| CC[C@@H]1CN(C(=O)NCC(F)(F)F)C[C@@H]1c3cnc4cnc2[nH]ccc2n34 | CN1CCC(c2ccc(Nc3ncc(C(F)(F)F)c(CCc4nccnc4CC(N)=O)n3)cc2)CC1 |
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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 | 0200800a 01000a00 005005a0 51850610 05000064 00004002 0000a800 20000001 10400900 000d0ad0 08308004 50819800 2a008002 00308a00 01820840 000c0004 08040020 1e004000 08403408 50a00201 44000500 1c50a600 25c04840 18500110 00042804 80000381 08000000 90010084 0400800c 00c6080a 40007000 200007a2 |