Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 2/20 | 0.53 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.43 |
| ▸ | ACP1 | P24666 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | STAT6 | P42226 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13769242 | 0.99 | CHEK2 (0.52) | CHEK2SMAD3HIF1AMAPTHRH4 | |
| SCHEMBL13769484 | 0.91 | HRH4 (0.55) | CHEK2MAPTHRH4MEN1KMT2A | |
| SCHEMBL1623317 | 0.90 | CHEK2 (0.51) | CHEK2SMAD3HIF1AMAPTHRH4 | |
| SCHEMBL1084915 | 0.89 | CHEK2 (0.57) | CHEK2SMAD3HIF1AMAPTHRH4 | |
| SCHEMBL1084592 | 0.89 | CHEK2 (0.57) | CHEK2SMAD3HIF1AMAPTHRH4 | |
| SCHEMBL1084434 | 0.89 | CHEK2 (0.50) | CHEK2SMAD3HIF1AMAPTHRH4 | |
| SCHEMBL1622861 | 0.89 | CHEK2 (0.56) | CHEK2SMAD3HIF1AMAPTHRH4 | |
| SCHEMBL183880 | 0.87 | CHEK2 (0.52) | CHEK2SMAD3HIF1AMAPTHRH4 | |
| SCHEMBL1084840 | 0.86 | CHEK2 (0.48) | CHEK2SMAD3HIF1AMAPTHRH4 | |
| SCHEMBL1623522 | 0.85 | CHEK2 (0.53) | CHEK2SMAD3HIF1AMAPTHRH4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007058989-A2 | QUINAZOLINES USEFUL AS MODULATORS OF VOLTAGE GATED ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-05-24 | — | — | WO | disclosed |