On Target BACE1_HUMAN 0.38219896/CHEMBL451950
For the given ligand STX, we have found in our database that, being scored 0.38219896, the most similar ligand is CHEMBL451950. Check out the elaboration below.
| STX (Given Ligand) | CHEMBL451950 (Similar Ligand) |
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| N=C3NC1C(COC(N)=O)NC(=N)N2CCC(O)(O)C12N3 | COC[C@H]1CCCN1C(=O)c1cc(C)cc(C(=O)N[C@@H](Cc2cc(F)cc(F)c2)[C@H](O)[C@@H]2NCN(Cc3ccccc3)C2=O)c1 |
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| 00000010 01400400 00100302 04210f00 00180080 00000010 00040005 a0002000 00200600 000201e2 06200002 40038000 0100b202 02802300 00001000 00380008 30a70010 00002000 00c02040 00000201 00000100 30032c30 13000081 02100010 00010003 00080002 40000200 30000000 08000210 00040017 801a0001 00002a00 | 00030018 01805c00 00100102 06010f00 00080081 00000010 10800004 22003004 00300880 00092de0 09300000 d003b000 1400980a 01203000 00081400 08080008 30804000 02002000 00c02840 00000201 80000100 382f8610 130000c0 8350001c 00010003 c0000000 88800000 90000001 0c300302 00068013 a01c4000 80800600 |