On Target PA_INFA 0.27702704/CHEMBL2040552
For the given ligand DB09134, we have found in our database that, being scored 0.27702704, the most similar ligand is CHEMBL2040552. Check out the elaboration below.
| DB09134 (Given Ligand) | CHEMBL2040552 (Similar Ligand) |
|---|---|
| O=C(CO)N(CCO)c1c(I)c(C(=O)NC[C@H](O)CO)c(I)c(C(=O)NC[C@H](O)CO)c1I | O=C(O)/C(O)=C/C(=O)c1ccc(N2CCNCC2)cc1 |
|
|
|
|
|
|
| 1000500a 00005800 40181100 00010600 04000081 08408000 10800000 02001000 00800201 00000c50 00280004 4000c000 00008842 02100000 00280440 18080008 10040000 02000000 08800900 20000204 40110040 18128600 27012080 0050001c 00040001 c0000000 08c00080 90000080 20408100 00060001 a0240000 00000200 | 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 |