Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 1/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.34 |
| ▸ | TCF7L2 | Q9NQB0 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KRAS | P01116 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GPR6 | P46095 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 2/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | CASR | P41180 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1621664 | 0.88 | MAPT (0.42) | CHEK2CTNNB1TCF7L2GAAKMT2A | |
| SCHEMBL183847 | 0.88 | CHEK2 (0.41) | CHEK2CTNNB1TCF7L2KRASLMNA | |
| Hydrochloric Acid SCHEMBL1624356 | 0.87 | MAPT (0.42) | CHEK2CTNNB1TCF7L2GAAKMT2A | |
| SCHEMBL6110398 | 0.86 | CHEK2 (0.45) | CHEK2CTNNB1TCF7L2KRASMAPT | |
| SCHEMBL1623253 | 0.85 | CHEK2 (0.44) | CHEK2KRASGPR6 | |
| SCHEMBL1622402 | 0.83 | CHEK2 (0.39) | CHEK2CTNNB1TCF7L2KMT2ALMNA | |
| SCHEMBL1623244 | 0.83 | SMAD3 (0.41) | CHEK2CTNNB1TCF7L2GAAKMT2A | |
| SCHEMBL1621931 | 0.81 | CHRNB2 (0.42) | MAPT | |
| SCHEMBL1623576 | 0.81 | CHEK2 (0.41) | CHEK2KRAS | |
| Hydrochloric Acid SCHEMBL1624492 | 0.81 | CHEK2 (0.41) | CHEK2KRAS |
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 |