Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 11/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3165629 | 0.93 | GSK3B (0.40) | GSK3BMAPTKDM4ELMNAALDH1A1 | |
| SCHEMBL3169880 | 0.87 | ADORA3 (0.46) | MAPTKDM4ELMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL3165370 | 0.86 | GFER (0.47) | GSK3BMAPTLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL3162425 | 0.82 | EGFR (0.53) | MAPTKDM4ELMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL3171920 | 0.80 | ADORA1 (0.47) | GSK3BKDM4EALDH1A1 | |
| SCHEMBL3170234 | 0.80 | ADORA1 (0.42) | ALDH1A1HSD17B10MAPK1CYP1A2CYP3A4 | |
| SCHEMBL3170239 | 0.80 | ADORA1 (0.42) | ALDH1A1HSD17B10MAPK1CYP1A2CYP3A4 | |
| SCHEMBL3164831 | 0.79 | MAPT (0.50) | MAPTKDM4ELMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL3163144 | 0.79 | ADORA3 (0.46) | MAPTKDM4ELMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL3163125 | 0.79 | NPC1 (0.47) | GSK3BMAPTKDM4EALDH1A1NPSR1 |
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-1465631-B1 | PYRIMIDINE A2B SELECTIVE ANTAGONIST COMPOUNDS, THEIR SYNTHESIS AND USE | OSI PHARM INC (US) | 2010-02-24 | — | — | EP | disclosed |