Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 5/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RAD52 | P43351 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL14535760 | 0.91 | CHEK2 (0.53) | HRH4MEN1KMT2ACHEK2TSHR | |
| SCHEMBL13769242 | 0.90 | CHEK2 (0.52) | HRH4MEN1KMT2ACHEK2TSHR | |
| SCHEMBL1623317 | 0.88 | CHEK2 (0.51) | HRH4MEN1KMT2ACHEK2CYP1A2 | |
| SCHEMBL1084434 | 0.88 | CHEK2 (0.50) | HRH4MEN1KMT2ACHEK2CYP1A2 | |
| SCHEMBL1084592 | 0.88 | CHEK2 (0.57) | HRH4MEN1KMT2ACHEK2TSHR | |
| SCHEMBL1084915 | 0.88 | CHEK2 (0.57) | HRH4MEN1KMT2ACHEK2CYP1A2 | |
| SCHEMBL1622861 | 0.87 | CHEK2 (0.56) | HRH4MEN1KMT2ACHEK2CYP1A2 | |
| SCHEMBL183880 | 0.85 | CHEK2 (0.52) | HRH4MEN1KMT2ACHEK2CYP1A2 | |
| SCHEMBL1084945 | 0.85 | MEN1 (0.51) | MEN1KMT2ACHEK2TSHRMAPK1 | |
| SCHEMBL1084840 | 0.84 | CHEK2 (0.48) | HRH4MEN1KMT2ACHEK2MAPT |
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 |