Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.36 |
| ▸ | APBA1 | Q02410 | 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 | |
|---|---|---|---|---|
| SCHEMBL4101721 | 0.75 | ALDH1A1 (0.56) | MAPTALDH1A1KDM4EGAAHPGD | |
| SCHEMBL12629768 | 0.72 | MAPT (0.52) | MAPTALDH1A1KDM4EGAAHPGD | |
| SCHEMBL1759326 | 0.71 | ALDH1A1 (0.72) | MAPTALDH1A1KDM4EGAAHPGD | |
| SCHEMBL29444102 | 0.70 | MAPT (1.00) | MAPTALDH1A1KDM4EGAAHPGD | |
| SCHEMBL503252 | 0.70 | MAPT (1.00) | MAPTALDH1A1KDM4EGAAHPGD | |
| SCHEMBL15722184 | 0.69 | MAPT (0.54) | MAPTALDH1A1KDM4EGAAHPGD | |
| SCHEMBL12630186 | 0.69 | MAPT (0.54) | MAPTALDH1A1KDM4EGAAHPGD | |
| SCHEMBL7990357 | 0.69 | MAPT (0.54) | MAPTALDH1A1KDM4EGAAHPGD | |
| SCHEMBL12630110 | 0.67 | MAPT (0.50) | MAPTALDH1A1KDM4EGAAHPGD | |
| SCHEMBL12663994 | 0.66 | MAPT (0.48) | MAPTALDH1A1KDM4EGAAHPGD |
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-2009111442-A1 | AMINO-QUINOXALINE AND AMINO-QUINOLINE COMPOUNDS FOR USE AS ADENOSINE A2a RECEPTOR ANTAGONISTS | SCHERING CORPORATION (US) | 2009-09-11 | — | — | WO | disclosed |