On Target NOS3_HUMAN 0.29444444/CHEMBL87187
For the given ligand Celecoxib, we have found in our database that, being scored 0.29444444, the most similar ligand is CHEMBL87187. Check out the elaboration below.
| Celecoxib (Given Ligand) | CHEMBL87187 (Similar Ligand) |
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| Cc3ccc(c1cc(C(F)(F)F)nn1c2ccc(S(N)(=O)=O)cc2)cc3 | Nc1cccc(-c2ccc(CCN3CCN(c4cccc5cccnc45)CC3)cc2)n1 |
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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 | 00006002 00000000 80104120 14010620 01040020 08000020 00000000 00080000 00000180 10080a40 08208004 40008800 00000802 00402000 00020041 02040004 00060000 02002000 0c200000 10600200 40100000 3c208008 30800821 83600012 00000002 80100000 000004c0 000000e0 0c40c00c 00460402 00040800 00000680 |