On Target NEP_HUMAN 0.5867347/CHEMBL198316
For the given ligand Icatibant, we have found in our database that, being scored 0.5867347, the most similar ligand is CHEMBL198316. Check out the elaboration below.
| Icatibant (Given Ligand) | CHEMBL198316 (Similar Ligand) |
|---|---|
| N=C(N)NCCC[C@@H](N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N2C[C@H](O)C[C@H]2C(=O)NCC(=O)N[C@@H](Cc3cccs3)C(=O)N[C@@H](CO)C(=O)N5Cc4ccccc4C[C@@H]5C(=O)N7[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C[C@@H]6CCCC[C@@H]67 | OC(=O)[C@H]1CCCC2N1C(=O)[C@H](Cc3ccccc23)NC(=O)[C@H](S)Cc4ccccc4 |
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| 00058008 01807200 00100100 14010e00 001800a0 00000010 01000080 2200300c 00200a80 004908c2 08300200 c003b080 1600b89a 01202003 82182480 121c4008 10000202 02000028 02c06008 00000205 80020900 783d8eb0 03004083 83500018 02402801 c6000005 40004000 90000204 0c000110 0086000b b80e4000 00c12e10 | 00018008 01807200 00100102 14110600 000800a0 00000002 81000000 2200100d 00000880 030f08c0 08300000 5081b000 0600888a 00a42001 801804a0 020c0008 10000200 02000000 00402008 00000201 80020100 38248e10 03004001 87500018 00000880 c0000001 00004000 90000040 0c000102 0186000b 20064000 03012600 |