On Target PA_INFA 0.26548672/CHEMBL2040554
For the given ligand DB12839, we have found in our database that, being scored 0.26548672, the most similar ligand is CHEMBL2040554. Check out the elaboration below.
| DB12839 (Given Ligand) | CHEMBL2040554 (Similar Ligand) |
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| COCCOCCCCCC(=O)NCCCC[C@H](N)C(=O)O | O=C(O)/C(O)=C/C(=O)C1(Cc2ccc(Cl)cc2)CCN(CC2CCCCC2)CC1 |
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| 00010000 01001000 00100000 00010500 00080000 00000000 00000000 20000040 00002000 00000080 00200000 4001b000 0400800a 00800000 00000000 00089008 00800000 00000000 00402000 00000201 00000020 10040e30 07000000 08100018 00000400 00000000 00000000 10000020 00000200 00040001 00000000 00002200 | 00028000 01000000 00100102 00010600 00000000 00000000 00000080 28000400 01100800 001808c0 08300000 5001d800 86028026 00200000 00000400 00080008 00000000 02000000 02252018 00000201 00000100 18000b90 04008000 00500010 00003800 80002400 00444000 90000000 00004000 00060002 04020000 00822600 |