On Target ACE2_HUMAN 0.2084942/CHEMBL1240682
For the given ligand ICV842, we have found in our database that, being scored 0.2084942, the most similar ligand is CHEMBL1240682. Check out the elaboration below.
| ICV842 (Given Ligand) | CHEMBL1240682 (Similar Ligand) |
|---|---|
| Cc3ccc(C(=O)Nc1ccc(S(=O)(=O)O)c2cc(S(=O)(=O)O)cc(S(=O)(=O)O)c12)cc3NC(=O)c8cccc(NC(=O)Nc7cccc(C(=O)Nc6cc(C(=O)Nc4ccc(S(=O)(=O)O)c5cc(S(=O)(=O)O)cc(S(=O)(=O)O)c45)ccc6C)c7)c8 | CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CC(=O)O)NC(=O)CN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O |
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| 1000c006 00c02800 40000100 40d10e40 04000200 0c020040 00000000 02003209 00881100 00080850 00682004 6000c020 80008800 08100402 80220340 10000000 00040000 02000000 08000000 00002000 c0100102 08228608 20032000 0854000c 00140000 80000000 00000910 d00010c0 24408100 40060001 82040000 00014220 | 04070002 01007a08 20100100 45910e10 041c12c0 00000010 02002020 2000200c 00600b80 020f0ac2 28308004 5003b800 1e00981a 01542801 811a0040 001c000c 10000000 0e000001 00e02418 40420301 60000d00 38358e38 23800283 97500018 00043801 80000200 48120000 10000100 0c000016 0046002b e00c4200 23812e20 |