On Target DRD2_HUMAN 0.5/CHEMBL3647674
For the given ligand Icatibant, we have found in our database that, being scored 0.5, the most similar ligand is CHEMBL3647674. Check out the elaboration below.
| Icatibant (Given Ligand) | CHEMBL3647674 (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 | C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc4ccccc4)NC(=O)[C@H](Cc5ccccc5)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](CCCCNC(=O)[C@H](Cc6ccc(F)cc6)NC1=O)NCCCC[C@@H]7C[C@H]8[C@@H](Cc9c[nH]c%10cccc8c9%10)N(C)C7 |
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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 | 00010002 21007a00 00100102 47810e10 00041380 00000010 00002000 2000200c 00700a80 000908c2 08300004 5003b000 9e00981a 00603801 80180040 001e000c 10000000 02000084 00a02408 00100201 40000100 38258638 23800083 93500018 00043801 80000000 48000040 10800001 0c400012 0006800b a00e4200 00002620 |