On Target TRPV3_HUMAN 0.38285714/CHEMBL3696429
For the given ligand aprepitant, we have found in our database that, being scored 0.38285714, the most similar ligand is CHEMBL3696429. Check out the elaboration below.
| aprepitant (Given Ligand) | CHEMBL3696429 (Similar Ligand) |
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| C[C@@H](O[C@H]2OCCN(Cc1nc(=O)[nH][nH]1)[C@H]2c3ccc(F)cc3)c4cc(C(F)(F)F)cc(C(F)(F)F)c4 | CC(C)[C@H](CO)NCc1cccc(n1)c2ccc(F)c(c2)C(F)(F)F |
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| 00000018 000d0008 40100100 82010e00 090000d1 00104014 00801c00 0a003441 04200900 00180870 0c211020 44008802 00008802 01011000 00261408 0228210c 18008040 02000182 04400000 40300000 00010020 08008030 33000000 00400010 10000400 c0002400 00080000 b4020001 00008306 00068002 c4540084 02002600 | 0000201a 00000000 00104100 12010e00 018400a1 00100012 00400400 02083041 00000000 10000850 00218004 40008002 00000802 01001000 00020400 020c010c 18020200 02003022 04600000 00500219 40000008 18018000 33800000 00400010 00100000 c0000000 00000040 90001041 00004104 00268400 20140800 00004200 |