On Target PPARA_HUMAN 0.32911393/CHEMBL4543257
For the given ligand Upadacitinib, we have found in our database that, being scored 0.32911393, the most similar ligand is CHEMBL4543257. Check out the elaboration below.
| Upadacitinib (Given Ligand) | CHEMBL4543257 (Similar Ligand) |
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| CC[C@@H]1CN(C(=O)NCC(F)(F)F)C[C@@H]1c3cnc4cnc2[nH]ccc2n34 | CCC(C)c1nn(-c2ccc(Cl)cc2)c2nc(C3CC3)cc(C(=O)O)c12 |
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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 | 0000800e 00001e08 60004100 58048600 010c4065 0000c406 02849000 00221a0c 00d00904 010d0ac0 2910800c 42818840 8a009806 01808000 00060040 0a0c200c 08208808 06800600 00600008 40220041 40000500 1c058b70 25800843 83600414 00002401 c0000200 001a8040 00010800 04000105 00c6000a c0060080 a00204a0 |