Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 10/20 | 0.51 |
| ▸ | IMPDH2 | P12268 | 11/20 | 0.41 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17653184 | 0.89 | AAK1 (0.53) | AAK1IMPDH2 | |
| SCHEMBL17653279 | 0.88 | AAK1 (0.58) | AAK1IMPDH2IMPDH1 | |
| SCHEMBL17653108 | 0.86 | AAK1 (0.49) | AAK1 | |
| SCHEMBL17653413 | 0.86 | AAK1 (0.54) | AAK1IMPDH2 | |
| SCHEMBL17653347 | 0.85 | AAK1 (0.41) | AAK1IMPDH2 | |
| SCHEMBL17653094 | 0.85 | AAK1 (0.38) | AAK1 | |
| SCHEMBL17653110 | 0.84 | IMPDH2 (0.46) | AAK1IMPDH2IMPDH1 | |
| SCHEMBL17653141 | 0.82 | AAK1 (0.38) | AAK1 | |
| SCHEMBL17653187 | 0.82 | AAK1 (0.46) | AAK1 | |
| SCHEMBL17653133 | 0.81 | AAK1 (0.42) | AAK1 |
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 |