Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 12/20 | 0.48 |
| ▸ | BRD4 | O60885 | 3/20 | 0.48 |
| ▸ | JAK3 | P52333 | 8/20 | 0.46 |
| ▸ | JAK1 | P23458 | 3/20 | 0.46 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | PTK2 | Q05397 | 6/20 | 0.43 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.42 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.42 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.42 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | BRD2 | P25440 | 1/20 | 0.41 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.41 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.41 |
| ▸ | TTK | P33981 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18376245 | 0.88 | JAK2 (0.53) | JAK2BRD4JAK3JAK1FGFR1 | |
| SCHEMBL29372248 | 0.88 | JAK2 (0.53) | JAK2BRD4JAK3JAK1FGFR1 | |
| SCHEMBL18377039 | 0.86 | JAK2 (0.52) | JAK2BRD4JAK3JAK1FGFR1 | |
| SCHEMBL29371281 | 0.85 | JAK2 (0.55) | JAK2BRD4JAK3JAK1FGFR1 | |
| SCHEMBL18376725 | 0.85 | JAK2 (0.55) | JAK2BRD4JAK3JAK1FGFR1 | |
| SCHEMBL18377038 | 0.84 | JAK2 (0.48) | JAK2BRD4JAK3JAK1FGFR1 | |
| SCHEMBL29371334 | 0.83 | JAK2 (0.56) | JAK2BRD4JAK3JAK1FGFR1 | |
| SCHEMBL18376246 | 0.83 | JAK2 (0.56) | JAK2BRD4JAK3JAK1FGFR1 | |
| SCHEMBL29368360 | 0.82 | JAK2 (0.53) | JAK2BRD4JAK3JAK1FGFR1 | |
| SCHEMBL18376742 | 0.82 | JAK2 (0.53) | JAK2BRD4JAK3JAK1FGFR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017005137-A1 | QUINAZOLINE COMPOUND, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USES THEREOF | 吉林大学 | 2017-01-12 | — | — | WO | disclosed |