On Target NK1R_HUMAN 0.3426295/CHEMBL214472
For the given ligand ticagrelor_Y, we have found in our database that, being scored 0.3426295, the most similar ligand is CHEMBL214472. Check out the elaboration below.
| ticagrelor_Y (Given Ligand) | CHEMBL214472 (Similar Ligand) |
|---|---|
| CCCSc5nc(N[C@@H]1C[C@H]1c2ccc(F)c(F)c2)c4nnn([C@@H]3C[C@H](OCCO)[C@@H](O)[C@H]3O)c4n5 | C[C@@H](O[C@H]1CC[C@H]([C@@H]1c2ccc(F)cc2)N(C)c3cnccn3)c4cc(cc(c4)C(F)(F)F)C(F)(F)F |
|
|
|
|
|
|
| 0001400b a3000b18 e01001a0 0a192720 20380060 0000e014 04008100 10102902 00020900 118868c0 0930000c 50019900 04011024 038c1100 70420281 100ed00c 04a41080 06014088 99c00020 00362041 80120120 18340050 27805044 8dc80015 00202c02 90000200 90040208 100050b1 0e300208 0146800a c0001000 0d2186c0 | 00000002 010d0000 00100102 02010720 20180051 08006010 00008400 00100040 00000900 200808d0 08300000 40038002 00000000 01a91000 00840001 020c100c 08a00000 02004080 04c02000 40b00001 00110120 58208030 21000880 81500011 00000402 80102000 00080600 90000089 0400020a 01469002 40101004 02000e80 |