Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 6/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL238371 | 1.00 | CHEK2 (0.58) | CHEK2KMT2AMEN1SMAD3MAPT | |
| SCHEMBL1621663 | 0.90 | CHEK2 (0.60) | CHEK2KMT2AMEN1SMAD3MAPT | |
| SCHEMBL184335 | 0.90 | CHEK2 (0.45) | CHEK2MAPTTSHRALDH1A1KDM4E | |
| SCHEMBL184333 | 0.90 | CHEK2 (0.45) | CHEK2MAPTTSHRALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL1624310 | 0.89 | CHEK2 (0.59) | CHEK2KMT2AMEN1SMAD3MAPT | |
| SCHEMBL4021314 | 0.87 | CHEK2 (0.56) | CHEK2KMT2AMEN1SMAD3MAPT | |
| SCHEMBL1622398 | 0.87 | CHEK2 (0.56) | CHEK2KMT2AMEN1SMAD3MAPT | |
| SCHEMBL239802 | 0.87 | CHEK2 (0.59) | CHEK2KMT2AMEN1SMAD3MAPT | |
| SCHEMBL239804 | 0.87 | CHEK2 (0.59) | CHEK2KMT2AMEN1SMAD3MAPT | |
| SCHEMBL4011372 | 0.86 | CHEK2 (0.67) | CHEK2KMT2AMEN1SMAD3MAPT |
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-1957482-B1 | QUINAZOLINES USEFUL AS MODULATORS OF VOLTAGE GATED ION CHANNELS | VERTEX PHARMA (US) | 2012-01-04 | — | — | EP | disclosed |