On Target ESR1_HUMAN 0.3265306/CHEMBL240438
For the given ligand Baloxavir, we have found in our database that, being scored 0.3265306, the most similar ligand is CHEMBL240438. Check out the elaboration below.
| Baloxavir (Given Ligand) | CHEMBL240438 (Similar Ligand) |
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| COC(=O)OCOc6c5C(=O)N1CCOC[C@H]1N([C@@H]4c2ccccc2SCc3c(F)c(F)ccc34)n5ccc6=O | C[C@H](NC(=O)Cc1c([nH]c2ccccc12)c3ccccc3)c4c(C)c5cc(O)ccc5n4Cc6ccc(OCCN7CCCCC7)cc6 |
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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 | 0400a00a 0180ca09 20100108 51010e12 000410a0 00100000 06042000 22083001 80500080 100908c0 08218004 50819000 13809826 00608000 e10a14c1 020c010c 10020208 82802006 04280400 00430a03 c0020201 18258618 32804000 91500418 00952000 c0000100 08224000 90000041 04004304 0006044b 20042a00 20004620 |