Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.51 |
| ▸ | PRNP | P04156 | 1/20 | 0.51 |
| ▸ | PPARG | P37231 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.51 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CLK1 | P49759 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5960232 | 0.81 | GAA (0.49) | CYP1A2CYP2C9CYP2C19RXFP1PRNP | |
| SCHEMBL30580683 | 0.81 | KDM4E (0.54) | MEN1KMT2AALDH1A1MAPTPOLB | |
| SCHEMBL3095750 | 0.72 | RXFP1 (0.68) | CYP1A2CYP2C9CYP2C19RXFP1PRNP | |
| SCHEMBL2150840 | 0.72 | ALOX5 (0.40) | MEN1KMT2AALDH1A1GAAMAPT | |
| SCHEMBL6986880 | 0.71 | NR4A2 (0.72) | SMN1; SMN2GABRA1GABRA3NR4A2 | |
| SCHEMBL25301691 | 0.71 | PRNP (0.50) | CYP1A2CYP2C9CYP2C19RXFP1PRNP | |
| SCHEMBL3001754 | 0.71 | ALOX15 (0.62) | CYP1A2CYP2C9CYP2C19RXFP1PRNP | |
| SCHEMBL16306763 | 0.71 | MAPT (0.57) | CYP1A2CYP2C9CYP2C19RXFP1PRNP | |
| SCHEMBL6049264 | 0.71 | GABRA1 (0.51) | NPSR1MEN1KMT2AALDH1A1GAA | |
| SCHEMBL31424548 | 0.70 | RXFP1 (0.65) | CYP1A2CYP2C9CYP2C19RXFP1PRNP |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2176256-A2 | TRISUBSTITUTED PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES | AstraZeneca AB (SE) | 2010-04-21 | — | — | EP | disclosed |
| WO-2009007751-A2 | TRISUBSTITUTED PYRIMIDINE DERIVATIVES FOR THE TREATMENT OF PROLIFERATIVE DISEASES | ASTRAZENECA AB (SE) | 2009-01-15 | — | — | WO | disclosed |