Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK2 | O43353 | 1/20 | 0.57 |
| ▸ | TNNI3K | Q59H18 | 8/20 | 0.56 |
| ▸ | BRAF | P15056 | 1/20 | 0.56 |
| ▸ | GAK | O14976 | 1/20 | 0.54 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.48 |
| ▸ | BRD4 | O60885 | 2/20 | 0.46 |
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.45 |
| ▸ | JAK1 | P23458 | 1/20 | 0.45 |
| ▸ | TYK2 | P29597 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 1/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.44 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.44 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.44 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29372255 | 0.90 | RIPK2 (0.69) | RIPK2PTK2BRD4EGFRJAK2 | |
| SCHEMBL18376248 | 0.90 | RORC (0.53) | RIPK2TNNI3KBRAFPTK2EGFR | |
| SCHEMBL18377044 | 0.90 | RIPK2 (0.69) | RIPK2PTK2BRD4EGFRJAK2 | |
| SCHEMBL29370809 | 0.85 | PIK3CG (0.60) | RIPK2PTK2EGFRPIK3CAPIK3CG | |
| SCHEMBL18377040 | 0.85 | PIK3CG (0.60) | RIPK2PTK2EGFRPIK3CAPIK3CG | |
| SCHEMBL18377036 | 0.83 | MAPK10 (0.55) | RIPK2EGFRPIK3CAPIK3CGPIK3CB | |
| SCHEMBL29371938 | 0.83 | MAPK10 (0.55) | RIPK2EGFRPIK3CAPIK3CGPIK3CB | |
| SCHEMBL18377055 | 0.83 | SRC (0.53) | RIPK2TNNI3KBRAFGAKPTK2 | |
| SCHEMBL18376750 | 0.83 | MAPK10 (0.60) | RIPK2PTK2EGFRJAK2JAK1 | |
| SCHEMBL29371294 | 0.83 | MAPK10 (0.60) | RIPK2PTK2EGFRJAK2JAK1 |
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 |