On Target NS5B_HCV1A 0.3963964/CHEMBL176058
For the given ligand Ivacaftor, we have found in our database that, being scored 0.3963964, the most similar ligand is CHEMBL176058. Check out the elaboration below.
| Ivacaftor (Given Ligand) | CHEMBL176058 (Similar Ligand) |
|---|---|
| CC(C)(C)c3cc(C(C)(C)C)c(NC(=O)c2c[nH]c1ccccc1c2=O)cc3O | CC(C)CCn1c(=O)c(C2=NS(=O)(=O)c3ccccc3N2)c(O)c2ccccc21 |
|
|
|
|
|
|
| 10004002 8080c808 20004102 40010610 10041003 00000060 02004000 02001200 02000000 40080840 09280024 4000c000 00008802 00708000 00020040 000c200c 00048080 02004004 08200000 00022400 c0100000 08068e08 20812000 8054001c 00040000 80000000 08920010 808c1080 00488100 00060003 c0040000 a0000600 | 10204012 0082d01a 21004102 04b11690 00441002 00000060 06084100 0a001400 06000310 c000c8f3 07202204 6001c000 21009806 02680001 80320044 040c200c 04040110 c2302004 08200000 0006200d c0120000 18018818 20812002 88720018 00044008 c0403000 48800080 940e00c8 00c48118 200600c1 e41ca018 84211a20 |