Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CLK1 | P49759 | 4/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.34 |
| ▸ | CLK2 | P49760 | 2/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.34 |
| ▸ | EDNRA | P25101 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | GLS | O94925 | 2/20 | 0.33 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3649060 | 0.91 | PTGDR2 (0.31) | PTGDR2GAAMAPTGLSSOS1 | |
| SCHEMBL3649058 | 0.88 | PTGDR2 (0.31) | PTGDR2GAAMAPTSOS1 | |
| SCHEMBL3649304 | 0.87 | CLK1 (0.35) | PTGDR2CLK1DYRK1ACLK2CLK4 | |
| SCHEMBL3650616 | 0.86 | HTR2C (0.37) | GLSSOS1HTR2CSLC6A4PDK2 | |
| SCHEMBL4024754 | 0.85 | PTGDR2 (0.36) | PTGDR2GAAMAPTEDNRADHFR | |
| SCHEMBL4131683 | 0.85 | EDNRA (0.40) | PTGDR2GAAMAPTCLK1DYRK1A | |
| SCHEMBL3652888 | 0.84 | GLS (0.34) | GLSSOS1HTR2CSLC6A4PDK2 | |
| SCHEMBL3647074 | 0.84 | GLS (0.34) | GLSSOS1HTR2CSLC6A4PDK2 | |
| SCHEMBL3652850 | 0.84 | SOS1 (0.39) | GLSSOS1HTR2CSLC6A4PDK2 | |
| SCHEMBL3646375 | 0.83 | SOS1 (0.30) | SOS1 |
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-2009041705-A9 | 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS | TAKEDA PHARMACEUTICAL (JP) | 2009-08-13 | — | — | WO | disclosed |