On Target IKKB_HUMAN 0.2820513/CHEMBL1672879
For the given ligand Captopril, we have found in our database that, being scored 0.2820513, the most similar ligand is CHEMBL1672879. Check out the elaboration below.
| Captopril (Given Ligand) | CHEMBL1672879 (Similar Ligand) |
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| C[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O | C[C@@]12CC\C=C(\COC(=O)CCCCCCCCCCCNC(=O)CCCC[C@@H]3SC[C@@H]4NC(=O)N[C@H]34)/CC[C@@H]5[C@H](OC(=O)C5=C)[C@H]1O2 |
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| 00010000 01005000 00100000 00100400 00080080 00000010 00000000 20000000 00000000 00000080 00200000 40013000 06008012 01040000 80080000 00080008 10000000 00000000 00400000 00400201 40000000 10040e00 03000200 00100018 00000000 00000000 00000000 10000000 00000000 00040021 20004000 01012200 | 00050040 c7003000 20100508 80110f40 001800c0 00000800 02000004 28002442 05202000 031040c8 40200000 40079000 0c03902e 02840100 00080404 00089008 04821000 00002000 21402070 0000a301 c0000120 30050e10 05008300 08300018 00211400 00000400 00406200 90000020 08000200 0004002b 240a0000 03812210 |