Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP1 | P24666 | 4/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GALR2 | O43603 | 3/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | GALR1 | P47211 | 1/20 | 0.40 |
| ▸ | WNT1 | P04628 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | BRAF | P15056 | 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 | |
|---|---|---|---|---|
| SCHEMBL3651441 | 0.85 | EGFR (0.46) | JAK2JAK3EGFRBTKNUAK1 | |
| SCHEMBL3643791 | 0.82 | SYK (0.51) | JAK2JAK3EGFRBTKKDR | |
| SCHEMBL12788855 | 0.82 | HRH3 (0.44) | HRH3ALDH1A1SMN1; SMN2GALR2WNT1 | |
| SCHEMBL12788849 | 0.80 | BRAF (0.41) | HRH3ALDH1A1GALR2EGFRBTK | |
| SCHEMBL3648467 | 0.80 | SYK (0.41) | EGFRBTKKDRCDK1GSK3B | |
| SCHEMBL3647130 | 0.77 | EGFR (0.45) | EGFRBTKMELK | |
| SCHEMBL3651562 | 0.76 | NLRP3 (0.49) | EGFRBTKDYRK1ABRAF | |
| SCHEMBL3651108 | 0.76 | CDK2 (0.42) | EGFRBTKCDK1GSK3BMET | |
| SCHEMBL12788837 | 0.76 | CYP1A2 (0.41) | HRH3ALDH1A1GALR2KDRCDK1 | |
| SCHEMBL3647473 | 0.75 | EGFR (0.44) | EGFRBTKMELK |
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 |
|---|---|---|---|---|---|---|---|
| US-8293757-B2 | 5-(4-(haloalkoxy)phenyl) pyrimidine-2-amine compounds and compositions as kinase inhibitors | IRM LLC (BM) | 2012-10-23 | — | — | US | disclosed |