Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 8/20 | 0.49 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | GPR142 | Q7Z601 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17653261 | 0.88 | AAK1 (0.38) | AAK1TLR9TLR7BRAFCYP11B1 | |
| SCHEMBL17653094 | 0.88 | AAK1 (0.38) | AAK1TLR9TLR7ELANEPTGDR2 | |
| SCHEMBL17653212 | 0.87 | AAK1 (0.53) | AAK1KCNA5 | |
| SCHEMBL17653173 | 0.86 | AAK1 (0.51) | AAK1 | |
| SCHEMBL17653133 | 0.86 | AAK1 (0.42) | AAK1BRAFKCNA5ALDH1A1TSHR | |
| SCHEMBL17653141 | 0.85 | AAK1 (0.38) | AAK1TLR9TLR7ELANEKDM4E | |
| SCHEMBL17653187 | 0.84 | AAK1 (0.46) | AAK1TLR9TLR7ELANEPTGDR2 | |
| SCHEMBL17653107 | 0.83 | KDM4E (0.41) | AAK1KDM4EUSP2ALDH1A1TSHR | |
| SCHEMBL17653252 | 0.80 | AAK1 (0.41) | AAK1USP2ALDH1A1LMNA | |
| SCHEMBL17653121 | 0.78 | CYP3A4 (0.34) | AAK1PTGDR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3200797-A1 | QUINAZOLINE-BASED KINASE INHIBITORS | Bristol-Myers Squibb Company (US) | 2017-08-09 | — | — | EP | disclosed |
| WO-2016053794-A1 | QUINAZOLINE-BASED KINASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2016-04-07 | — | — | WO | disclosed |