Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AXL | P30530 | 1/20 | 0.41 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.41 |
| ▸ | MERTK | Q12866 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.36 |
| ▸ | DGAT2 | Q96PD7 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 2/20 | 0.35 |
| ▸ | CLK1 | P49759 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29930779 | 0.90 | AXL (0.41) | AXLTYRO3MERTKDGAT1SMN1; SMN2 | |
| SCHEMBL1592834 | 0.88 | MERTK (0.39) | AXLTYRO3MERTKDGAT1ALDH1A1 | |
| SCHEMBL29930407 | 0.87 | DYRK1B (0.39) | AXLTYRO3MERTKDGAT1PDE1B | |
| SCHEMBL29930401 | 0.85 | DYRK1B (0.40) | AXLMERTKDGAT1SRCKDR | |
| SCHEMBL29930863 | 0.84 | DYRK1B (0.47) | AXLTYRO3MERTKHSD17B10ALDH1A1 | |
| SCHEMBL29930812 | 0.83 | PDE4A (0.39) | ALDH1A1MAPTKDM4EKMT2AMEN1 | |
| SCHEMBL29930809 | 0.83 | DGAT1 (0.37) | AXLMERTKDGAT1SMN1; SMN2ALDH1A1 | |
| SCHEMBL29930508 | 0.82 | DGAT1 (0.36) | MERTKDGAT1MAPTPDE1BDYRK1B | |
| SCHEMBL29930954 | 0.82 | DYRK1A (0.46) | NPSR1KDM4EPDE1BDYRK1B | |
| SCHEMBL3375894 | 0.81 | DGAT1 (0.40) | AXLTYRO3MERTKMAOBDGAT1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022235097-A1 | PHARMACEUTICAL COMPOSITION CONTAINING NOVEL PYRAZOLO[3,4-B]PYRIDINE DERIVATIVE FOR PREVENTION OR TREATMENT OF METABOLIC DISEASE INCLUDING OBESITY AND DIABETES MELLITUS OR NONALCOHOLIC STEATOHEPATITIS | 한국화학연구원 | 2022-11-10 | — | — | WO | disclosed |