Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 5/20 | 0.62 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1084341 | 0.89 | HIF1A (0.57) | CHEK2SMAD3MEN1KMT2AHIF1A | |
| SCHEMBL183923 | 0.88 | CHEK2 (0.58) | CHEK2SMAD3MEN1KMT2AHIF1A | |
| SCHEMBL183922 | 0.88 | CHEK2 (0.58) | CHEK2SMAD3MEN1KMT2AHIF1A | |
| SCHEMBL1084929 | 0.88 | CHEK2 (0.56) | CHEK2SMAD3MEN1KMT2AHIF1A | |
| SCHEMBL1084555 | 0.88 | CHEK2 (0.80) | CHEK2SMAD3MEN1KMT2AHIF1A | |
| SCHEMBL1084832 | 0.88 | CHEK2 (0.80) | CHEK2SMAD3MEN1KMT2AHIF1A | |
| SCHEMBL1084343 | 0.87 | CHEK2 (0.56) | CHEK2SMAD3MEN1KMT2AHIF1A | |
| SCHEMBL1084638 | 0.87 | CHEK2 (0.56) | CHEK2SMAD3MEN1KMT2AHIF1A | |
| SCHEMBL1621893 | 0.86 | SMAD3 (0.56) | CHEK2SMAD3MEN1KMT2AHIF1A | |
| SCHEMBL1623570 | 0.86 | CHEK2 (0.55) | CHEK2SMAD3MEN1KMT2AHIF1A |
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 |