Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.65 |
| ▸ | BTK | Q06187 | 6/20 | 0.53 |
| ▸ | ITK | Q08881 | 6/20 | 0.53 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.51 |
| ▸ | GSK3A | P49840 | 3/20 | 0.49 |
| ▸ | GSK3B | P49841 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.49 |
| ▸ | KIT | P10721 | 1/20 | 0.48 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.47 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 1/20 | 0.47 |
| ▸ | CDK9 | P50750 | 1/20 | 0.47 |
| ▸ | AXL | P30530 | 1/20 | 0.46 |
| ▸ | CDK8 | P49336 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7114155 | 0.89 | GSK3A (0.62) | AAK1BTKITKGSK3AGSK3B | |
| SCHEMBL7116485 | 0.89 | AAK1 (0.60) | AAK1RIPK1GSK3AGSK3BAXL | |
| SCHEMBL4308629 | 0.88 | KIT (0.57) | AAK1BTKITKGSK3AGSK3B | |
| SCHEMBL7117585 | 0.88 | AXL (0.61) | AAK1BTKITKGSK3AGSK3B | |
| SCHEMBL7051030 | 0.88 | ADORA1 (0.53) | AAK1BTKITKGSK3AGSK3B | |
| SCHEMBL7117475 | 0.87 | AAK1 (0.62) | AAK1GSK3AGSK3BKITAXL | |
| SCHEMBL7116630 | 0.87 | AAK1 (0.56) | AAK1BTKITKGSK3AGSK3B | |
| SCHEMBL4301384 | 0.86 | NTRK1 (0.62) | AAK1BTKITKRIPK1KIT | |
| SCHEMBL4297488 | 0.84 | GSK3B (0.62) | AAK1GSK3AGSK3BKITAXL | |
| SCHEMBL7118788 | 0.84 | AAK1 (0.58) | AAK1BTKITKGSK3AGSK3B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003028724-A1 | CHK1 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-04-10 | — | — | WO | claimed |
| WO-2003028724-A1 | CHK1 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-04-10 | — | — | WO | disclosed |