On Target BACE1_HUMAN 0.3638889/CHEMBL3947150
For the given ligand Baloxavir, we have found in our database that, being scored 0.3638889, the most similar ligand is CHEMBL3947150. Check out the elaboration below.
| Baloxavir (Given Ligand) | CHEMBL3947150 (Similar Ligand) |
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| COC(=O)OCOc6c5C(=O)N1CCOC[C@H]1N([C@@H]4c2ccccc2SCc3c(F)c(F)ccc34)n5ccc6=O | COc1ccc(nc1)C(=O)Nc2ccc3Oc4c(F)cc(cc4C5(CCSC(=N5)N)c3c2)N6CCOCC6 |
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| 008002be 0380ce08 671a6508 93310e00 041e11a8 00720136 184c0404 03247603 02304001 007b68c0 4b690414 708580b8 58009d06 48741008 01021478 022c610d 34025208 0200459a 00380060 001a0203 c0060501 0843ae00 72806000 4250811d 24102410 f0000081 84904860 e0040001 0b083384 04cfc013 94040001 c0c547a8 | 08004002 00201808 60105149 d2118e60 140610a0 08900114 03af0000 03601609 04c00804 00886852 883d4014 7006c0c0 00018826 081c1808 01021859 020c290c 14044800 03000000 08202020 00020001 64500100 38828600 32812300 06408c34 80142618 f0100001 c8260040 c0220081 08508b84 00068013 82060400 01014600 |