On Target NOS3_HUMAN 0.24390244/CHEMBL40391
For the given ligand Baricitinib, we have found in our database that, being scored 0.24390244, the most similar ligand is CHEMBL40391. Check out the elaboration below.
| Baricitinib (Given Ligand) | CHEMBL40391 (Similar Ligand) |
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| CCS(=O)(=O)N4CC(CC#N)(n3cc(c1ncnc2[nH]ccc12)cn3)C4 | Nc1cccc(-c2ccc(CCN3CCN(CC(=O)c4ccccc4)CC3)cc2)n1 |
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| 00010006 45810808 20180180 41b40e12 20080000 00006108 00000000 00102000 00204300 00400880 0020240c 64010800 82005c00 00940001 80420801 880c800c 00420040 82402004 04e80000 0c227003 c0000000 3c078070 21802cc1 32500134 0a010233 80000008 00100000 1000004c 0840000c 004e8011 c0080200 400106f0 | 00002002 00000800 80104100 14010600 01040020 00000000 00000000 00080000 00000180 10080840 08208004 4000a800 02008802 00002001 00020000 02040004 00020000 02002000 04200000 10600200 40000000 3c228200 30800821 83600014 00000000 80000000 000000c0 00000060 0c40400c 00060402 80004800 00000600 |