On Target TNFA_HUMAN 0.3686636/CHEMBL143886
For the given ligand Celecoxib, we have found in our database that, being scored 0.3686636, the most similar ligand is CHEMBL143886. Check out the elaboration below.
| Celecoxib (Given Ligand) | CHEMBL143886 (Similar Ligand) |
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| Cc3ccc(c1cc(C(F)(F)F)nn1c2ccc(S(N)(=O)=O)cc2)cc3 | C[C@H]1CN(CCOc2ccc(NC(=O)Nc3cc(nn3c4ccc(C)cc4)C(C)(C)C)c5ccccc25)C[C@H](C)O1 |
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| 00006036 00802208 a1100100 00b10600 01080010 00004002 00440400 00001400 00000104 000108f0 0900a004 6000800a 00000810 02000201 80200040 000c200c 00020000 02801000 04400000 10222008 c0100000 1801a020 30800800 8b404008 00000000 c0000040 30c20000 90000869 04004104 20460008 40260200 800126a2 | 04002007 00000a08 20100108 80058e42 05085080 00004002 02800000 00003209 00400104 500d08d0 09388004 40008010 80808a22 08300000 01291049 001c610c 10040000 0a800000 88400000 00220240 44000180 18058428 33826800 83410030 00342400 c0000000 20170000 110008c1 0400831c 0046010b 40060000 800066e0 |