On Target NK2R_HUMAN 0.3531915/CHEMBL311857
For the given ligand yong1, we have found in our database that, being scored 0.3531915, the most similar ligand is CHEMBL311857. Check out the elaboration below.
| yong1 (Given Ligand) | CHEMBL311857 (Similar Ligand) |
|---|---|
| [H][C@@]12/C(CO)=C\[C@H](OC)[C@]1([H])/C(C(=O)OC)=C\O[C@H]2OC3OC(CO)C(O)C(O)C3O | CCOC(=O)C1=C(C)OC2OC(COCc3ccccc3)C(OCc4ccccc4)C(O)C2[S+]1[O-] |
|
|
|
|
|
|
| 00050040 81000000 00000801 90010101 80290041 00000801 00022880 28011402 01200000 015080e8 48000200 40419011 8402802a 02800000 02000405 012a9008 00820004 00000100 1145e010 00008a01 00100020 00001a90 0500a000 08100010 00201420 80201400 00405002 a4000020 00004240 00000000 1ea0a000 00000010 | 00000008 01040400 80080121 10d1030b 802d0050 00006828 2a022c80 08001640 05a42100 01004860 4000b001 400a8040 80818002 86850000 02000011 03289008 04c2200e 02000000 3145e050 00000d01 50105020 18000aa2 05010700 086a0010 28029420 8000203c 02481000 24002060 040052c0 00036020 4ea0a120 07119098 |