On Target GP_EBOV 0.17966102/CHEMBL3125899
For the given ligand LIGAND 70, we have found in our database that, being scored 0.17966102, the most similar ligand is CHEMBL3125899. Check out the elaboration below.
| LIGAND 70 (Given Ligand) | CHEMBL3125899 (Similar Ligand) |
|---|---|
| O=C(O)c6cc(C(c4cc(Cc3cc(C(c1ccc(O)c(C(=O)O)c1)c2ccc(O)c(C(=O)O)c2)cc(C(=O)O)c3O)cc(C(=O)O)c4O)=c5ccc(=O)c(C(=O)O)c5)ccc6O | CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CSCC(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]2CC[C@@]2(C)[C@H]3CC[C@@H]2[C@H](C)CCCC(C)C)C1)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)CC)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O |
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| 00000002 80040808 20000100 00090280 40200001 00024001 82200280 03000e02 01000100 00180a40 28000000 40009200 14028002 20020000 00000002 0808600c 00000400 02000000 10490090 42022001 00002011 08020aa0 01408001 00400816 00201000 a0000400 00522008 c0800000 00404080 88220002 c6000000 01000400 | 04070002 41007e00 20120901 45910750 041d12c0 00000030 00002020 2000040e 00600980 001b4bc8 2830b204 5007b800 1e03883a 81d42801 811a0454 000c100c 14820000 0e000021 02e02418 40408201 60000d20 383c9e3a 2380a283 93500018 1825be01 80000210 08406000 90002140 0c000206 0146003b 64064200 27812e20 |