On Target EDNRA_HUMAN 0.3898305/CHEMBL10847
For the given ligand HU-580, we have found in our database that, being scored 0.3898305, the most similar ligand is CHEMBL10847. Check out the elaboration below.
| HU-580 (Given Ligand) | CHEMBL10847 (Similar Ligand) |
|---|---|
| C=C(C)[C@@H]1CC/C(C)=C\[C@H]1c2c(O)cc(CCCCC)c(C(=O)OC)c2O | [Na+].COc1ccc(cc1C)C(=O)\C(=C(/C(=O)[O-])\c2cc(OC)c3OCOc3c2)\Cc4ccc(OC)c(OC)c4OC |
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| 00000001 43000808 20000103 00010202 00010001 4082c400 02000001 00000e02 00040900 00980a42 28100000 40408840 00028022 00210000 00000420 0a082008 00020800 02100020 00202000 40020a01 00400500 08020a60 0100c000 00400014 00200000 80002201 04424200 80000000 00000203 00024002 e4020004 00010400 | 00000001 43000c08 2000030b 00810202 00001141 40800000 c6040081 00000600 01a40800 00b80840 48100000 40109040 0500c022 20200000 41040003 082aa008 08000400 02100004 00298018 00020a01 00040300 08020a80 01008001 00400414 41203800 c4004400 00522000 60010000 01440300 0002410a 84002000 00010d00 |