On Target PA_INFA 0.19685039/CHEMBL2040552
For the given ligand MOLECULE 127, we have found in our database that, being scored 0.19685039, the most similar ligand is CHEMBL2040552. Check out the elaboration below.
| MOLECULE 127 (Given Ligand) | CHEMBL2040552 (Similar Ligand) |
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| Nc2ccc1cc(S(=O)(=O)O)ccc1c2/N=N/c7ccc(/C=C/c6ccc(/C=C/c5ccc(/N=N/c3c(N)ccc4cc(S(=O)(=O)O)ccc34)cc5)cc6)cc7 | O=C(O)/C(O)=C/C(=O)c1ccc(N2CCNCC2)cc1 |
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| 00000002 00800800 40000100 00d10200 00004000 00000000 80000080 00000600 00000300 00080840 00002104 60008000 00000000 08000002 80240352 00000000 00008400 02800000 00000000 00002000 c1000000 18000008 20000002 08482008 00010000 81000000 80402010 40000000 00500000 00060001 06000000 00012020 | 00004002 00000800 00000120 c4010600 00000000 00800000 00000001 00000400 01000000 00980a40 08200004 4000c000 80008002 0000a000 00000040 00080008 00040400 02100000 08250010 00000800 40100000 38020a80 24008020 02400016 00001000 84004400 00400000 00000080 0800c000 00060002 84000000 00000600 |