On Target RT_HIV1 0.3952569/CHEMBL3683703
For the given ligand Danoprevir, we have found in our database that, being scored 0.3952569, the most similar ligand is CHEMBL3683703. Check out the elaboration below.
| Danoprevir (Given Ligand) | CHEMBL3683703 (Similar Ligand) |
|---|---|
| CC(C)(C)OC(=O)N[C@@H]6CCCCC/C=C\[C@@H]1C[C@@]1(C(=O)NS(=O)(=O)C2CC2)NC(=O)[C@@H]5C[C@@H](OC(=O)N4Cc3cccc(F)c3C4)CN5C6=O | CCCCCN([C@H](CO)CCC(F)(F)CNC(=O)[C@@H](NC(=O)OC)C(c1ccccc1)c1ccccc1)S(=O)(=O)c1ccc(CO)cc1 |
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| 00050280 0dc07800 00100300 97310700 00100080 00018010 000a0001 a200140a 10800200 0050a8c8 00202400 5101b000 0e02c81a 01243303 805814a0 081a8008 12266200 02080140 40e12810 02004201 80020000 bc148e70 13008083 3254003c 02200001 c0281003 00c04200 9020002d 0c000300 81068487 a4064000 01012a70 | 00000010 09803200 01100100 05b10600 00081088 0001e0c0 00000000 2100000c 00c40b00 804808c0 08302000 6001b000 0c008002 00c02001 80680000 001e0008 10022000 02080000 00402018 00006601 80000100 38340e30 03100001 db700058 02000800 a0000006 00000020 d000002c 0c000680 2606000b e0004000 00012670 |