On Target CALCR_HUMAN 0.27027026/CHEMBL2369897
For the given ligand chenyan1, we have found in our database that, being scored 0.27027026, the most similar ligand is CHEMBL2369897. Check out the elaboration below.
| chenyan1 (Given Ligand) | CHEMBL2369897 (Similar Ligand) |
|---|---|
| Cc1ccc4c(c1)[nH+]c(/C=C/c2cccc3cccnc23)n4c6cccc(OCCCN5CCN(C)CC5)c6 | CCCC[C@H](NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N)NC(=O)CNC(=O)[C@@H](N)CS)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)[C@H](Cc3ccccc3)NC(=O)C(Cc4c[nH]cn4)N[C@@H](CCC)C(=O)N[C@@H](Cc5ccc(O)cc5)C(=O)N6CCC[C@@H]6C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](C)C(=O)N7CCC[C@@H]7C(=O)N |
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| 04010002 80800a08 20104908 16050e10 00041064 06004000 a20080a0 08001408 00100104 000038c0 1120800c 40018000 00811802 0840a200 81060043 024c200c 08200408 02000004 00e00000 00420602 c0000000 38008038 a18000e1 83418010 00040001 c2000041 0840a040 40000200 0c418204 00460848 44040000 020002e0 | 04070002 01007608 20100102 05910610 041002c0 00000010 02002020 2000000c 00700980 020f0be0 2830a000 5003b800 1e00801a 00342801 811a0000 000c000c 10000000 0e000001 00c02018 40420301 60000d00 383c0e30 23000283 97500018 00041801 80000200 00120000 10000100 0c000006 0046003b 60024000 23812e00 |