Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 2/20 | 0.40 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.40 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | PRNP | P04156 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.36 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7824030 | 0.76 | SIRT1 (0.40) | PIM1PIM3SIRT1LMNAHPGD | |
| SCHEMBL27810837 | 0.72 | SIRT1 (0.37) | PIM1PIM3SIRT1LMNAHPGD | |
| SCHEMBL28460398 | 0.72 | PIM1 (0.46) | PIM1PIM3LMNAHPGDGSK3B | |
| SCHEMBL29951828 | 0.72 | PIM1 (0.46) | PIM1PIM3LMNAHPGDGSK3B | |
| SCHEMBL16920112 | 0.72 | PIM1 (0.46) | PIM1PIM3LMNAHPGDGSK3B | |
| SCHEMBL3198006 | 0.72 | LMNA (0.51) | PIM1PIM3LMNAHPGDGSK3B | |
| SCHEMBL29954657 | 0.69 | LMNA (0.44) | PIM1PIM3LMNAHPGDGSK3B | |
| SCHEMBL29951788 | 0.69 | HPGD (0.44) | PIM1PIM3LMNAHPGDGSK3B | |
| SCHEMBL29955514 | 0.69 | RXFP1 (0.58) | PIM1PIM3SIRT1LMNAGSK3B | |
| SCHEMBL29957448 | 0.68 | CYP2D6 (0.42) | PIM1PIM3SIRT1LMNAHPGD |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113646050-A | Thieno [3,2-B ] pyrrolo [3,2-D ] pyridazinone derivatives and their use as PKM2 derivatives for the treatment of cancer, obesity and diabetes related disorders | 安吉奥斯医药品有限公司 | 2021-11-12 | — | — | CN | disclosed |