On Target CASP1_HUMAN 0.51086956/CHEMBL59362
For the given ligand Icatibant, we have found in our database that, being scored 0.51086956, the most similar ligand is CHEMBL59362. Check out the elaboration below.
| Icatibant (Given Ligand) | CHEMBL59362 (Similar Ligand) |
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| 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 | CC(C)[C@H](NC(=O)CCc1ccccc1)C(=O)N[C@@H](C)C(=O)NC(CC(=O)O)C(=O)CN(CCc2ccccc2)Cc3ccccc3 |
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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 | 00058000 01003600 00100100 04010600 00080000 00000000 00000000 22001008 00000880 000809e0 08300000 4001b000 0e008812 01002001 80000400 000c0008 00000000 02000001 00c00018 00000201 00000100 38388e00 01000083 83500018 00001801 c0000000 00000000 90000000 0c000102 0006001b 20044000 00002600 |