Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.41 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.39 |
| ▸ | KHK | P50053 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13769235 | 0.94 | HRH4 (0.45) | MAPTCHEK2HRH4IRAK1IRAK4 | |
| SCHEMBL183511 | 0.88 | CHEK2 (0.58) | MAPTCHEK2HRH4CYP1A2CYP3A4 | |
| SCHEMBL184238 | 0.88 | CHEK2 (0.58) | MAPTCHEK2HRH4CYP1A2CYP3A4 | |
| SCHEMBL183512 | 0.88 | CHEK2 (0.58) | MAPTCHEK2HRH4CYP1A2CYP3A4 | |
| SCHEMBL13769465 | 0.86 | CYP1A2 (0.53) | MAPTCHEK2CYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL14535451 | 0.85 | MAPT (0.42) | MAPTCHEK2HRH4IRAK1IRAK4 | |
| SCHEMBL2734806 | 0.83 | ABCB1 (0.52) | MAPTHRH4CYP1A2CYP3A4ALDH1A1 | |
| SCHEMBL14535453 | 0.82 | MAPT (0.43) | MAPTCHEK2HRH4CYP1A2CYP3A4 | |
| SCHEMBL1623958 | 0.82 | SMAD3 (0.55) | MAPTCHEK2HRH4ALDH1A1HSD17B10 | |
| SCHEMBL1623723 | 0.82 | SMAD3 (0.55) | MAPTCHEK2HRH4ALDH1A1HSD17B10 |
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-1784393-B1 | QUINAZOLINES USEFUL AS MODULATORS OF ION CHANNELS | VERTEX PHARMA (US) | 2009-07-01 | — | — | EP | disclosed |