On Target MMP2_HUMAN 0.44878048/CHEMBL5864271
For the given ligand Upadacitinib, we have found in our database that, being scored 0.44878048, the most similar ligand is CHEMBL5864271. Check out the elaboration below.
| Upadacitinib (Given Ligand) | CHEMBL5864271 (Similar Ligand) |
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| CC[C@@H]1CN(C(=O)NCC(F)(F)F)C[C@@H]1c3cnc4cnc2[nH]ccc2n34 | C[C@H]1CN(C(=O)CCC2(c3cnccn3)NC(=O)NC2=O)CCN1c1cccc(F)c1 |
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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 | 1803c00a 01003000 00100c22 17800e10 00000140 00100010 0100e004 2000700f 14700800 000b4ac0 01218004 6003b000 06019012 00003800 01820040 00040104 08044008 0e002000 08000408 00000a01 c0320100 38258e20 21000021 1210001a 00151000 00000080 08000000 90000085 0c009004 00868801 20087000 a0c02200 |