On Target RT_HIV1 0.24647887/CHEMBL4225614
For the given ligand 222, we have found in our database that, being scored 0.24647887, the most similar ligand is CHEMBL4225614. Check out the elaboration below.
| 222 (Given Ligand) | CHEMBL4225614 (Similar Ligand) |
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| CC(=O)NC1C(O)OC(CO)C(O)C1O | C=C(C)[C@@H]1CC[C@]2(CNCCCN3CCOCC3)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(c6ccc(C(=O)O)cc6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 |
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| 00000000 01005000 00100000 80010500 803800c0 00000000 00002800 20000000 00000000 010000a0 00200000 40018000 00008002 03800000 00001008 00299008 10000000 00000000 11c02000 00000201 00000020 10140600 17000080 08100018 10000401 00000000 00800200 30000021 00000200 00040001 00a00000 00000a00 | 00000000 01000c00 00100302 c0050600 00000080 00004000 80000080 20000402 00000900 001809e0 08300000 40018800 00028002 00200000 0008140a 00080108 10000400 02000020 02012000 00000201 01000100 18020a30 12008020 00500014 01200400 80000000 00406000 d0000001 00400202 01060012 e4020000 00002600 |