Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | GBA1 | P04062 | 2/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.38 |
| ▸ | TCF7L2 | Q9NQB0 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5500371 | 0.94 | KMT2A (0.53) | MEN1KMT2ASMAD3MAPTTSHR | |
| SCHEMBL5504311 | 0.94 | KMT2A (0.53) | MEN1KMT2ASMAD3MAPTTSHR | |
| SCHEMBL5500395 | 0.88 | CHEK2 (0.43) | MEN1KMT2AMAPTGBA1CHEK2 | |
| SCHEMBL1084754 | 0.83 | MAPT (0.60) | MEN1KMT2ASMAD3MAPTTSHR | |
| SCHEMBL5504061 | 0.80 | ALDH1A1 (0.52) | MEN1KMT2ASMAD3MAPTTSHR | |
| SCHEMBL1623455 | 0.79 | MEN1 (0.48) | MEN1KMT2ASMAD3MAPTTSHR | |
| SCHEMBL13769477 | 0.78 | MEN1 (0.76) | MEN1KMT2ASMAD3MAPTTSHR | |
| SCHEMBL2734047 | 0.78 | SMAD3 (0.73) | MEN1KMT2ASMAD3MAPTTSHR | |
| SCHEMBL1084407 | 0.78 | CHEK2 (0.48) | MEN1KMT2ASMAD3MAPTTSHR | |
| SCHEMBL1622993 | 0.77 | MEN1 (0.53) | MEN1KMT2ASMAD3MAPTTSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1784393-A1 | QUINAZOLINES USEFUL AS MODULATORS OF ION CHANNELS | Vertex Pharmaceuticals Incorporated (US) | 2007-05-16 | — | — | EP | disclosed |
| WO-2006028904-A9 | QUINAZOLINES USEFUL AS MODULATORS OF ION CHANNELS | VERTEX PHARMA (US) | 2006-06-22 | — | — | WO | disclosed |
| WO-2006028904-A1 | QUINAZOLINES USEFUL AS MODULATORS OF ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2006-03-16 | — | — | WO | disclosed |