Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.40 |
| ▸ | PSD | A5PKW4 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 2/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL5548526 | 0.91 | EPHB4 (0.39) | GRM2EPHB4PSDXDHADORA2A | |
| SCHEMBL5548905 | 0.83 | ADORA2A (0.39) | GRM2EPHB4PSDXDHPGR | |
| SCHEMBL5543550 | 0.79 | LRRK2 (0.40) | PSDXDHIDO1CYP1A2HSD17B10 | |
| SCHEMBL3530232 | 0.72 | GSK3A (0.46) | CYP1A2CYP3A4CYP2D6SMN1; SMN2GSK3A | |
| SCHEMBL5545643 | 0.72 | GSK3B (0.34) | GSK3A | |
| SCHEMBL5545495 | 0.68 | TP53 (0.41) | ADORA2AIDO1MAP4K4TRPA1CLK4 | |
| SCHEMBL5543611 | 0.65 | KDM5B (0.41) | HSD17B10ALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL5549374 | 0.64 | METAP1 (0.42) | EPHB4CYP3A4CLK4 | |
| SCHEMBL2816359 | 0.63 | ADORA2A (0.49) | ADORA2ACYP1A2HSD17B10USP2ALDH1A1 | |
| SCHEMBL2198227 | 0.63 | CYP1A2 (0.44) | PGRCYP1A2HSD17B10USP2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1678180-B1 | SUBSTITUTED 2H-[1,2,4]TRIAZOLO 4,3-A PYRAZINES AS GSK-3 INHIBITORS | PFIZER PROD INC (US) | 2007-08-08 | — | — | EP | disclosed |