Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KRAS | P01116 | 5/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | HMOX2 | P30519 | 1/20 | 0.36 |
| ▸ | CRYZ | Q08257 | 1/20 | 0.36 |
| ▸ | VAT1 | Q99536 | 1/20 | 0.36 |
| ▸ | RTN4 | Q9NQC3 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1623848 | 0.85 | CHEK2 (0.42) | CHEK2LMNATP53KRASMAPT | |
| SCHEMBL13568165 | 0.85 | CHEK2 (0.42) | CHEK2LMNATP53KRASMAPT | |
| SCHEMBL1623851 | 0.85 | CHEK2 (0.42) | CHEK2LMNATP53KRASMAPT | |
| Hydrochloric Acid SCHEMBL1622281 | 0.84 | CHEK2 (0.42) | CHEK2LMNATP53KRASMAPT | |
| Hydrochloric Acid SCHEMBL1622285 | 0.84 | CHEK2 (0.42) | CHEK2LMNATP53KRASMAPT | |
| SCHEMBL1084945 | 0.84 | MEN1 (0.51) | CHEK2LMNAMAPTMEN1KMT2A | |
| SCHEMBL1622534 | 0.84 | CHEK2 (0.44) | CHEK2KRASMAPTHRH4MEN1 | |
| SCHEMBL13079915 | 0.84 | CHEK2 (0.44) | CHEK2KRASMAPTHRH4MEN1 | |
| SCHEMBL1622531 | 0.84 | CHEK2 (0.44) | CHEK2KRASMAPTHRH4MEN1 | |
| SCHEMBL13769484 | 0.82 | HRH4 (0.55) | CHEK2LMNAMAPTHRH4MEN1 |
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 |