Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.71 |
| ▸ | CDK4 | P11802 | 2/20 | 0.56 |
| ▸ | CCND1 | P24385 | 2/20 | 0.56 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.56 |
| ▸ | CDK2 | P24941 | 2/20 | 0.56 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.55 |
| ▸ | SYK | P43405 | 3/20 | 0.54 |
| ▸ | JAK2 | O60674 | 9/20 | 0.54 |
| ▸ | JAK3 | P52333 | 1/20 | 0.54 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.54 |
| ▸ | BRD4 | O60885 | 3/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL18376844 | 0.92 | EGFR (0.65) | EGFRCDK2FGFR2SYKJAK2 | |
| SCHEMBL18376592 | 0.91 | EGFR (0.68) | EGFRCDK4CCND1CCNE1CDK2 | |
| SCHEMBL29372582 | 0.91 | EGFR (0.68) | EGFRCDK4CCND1CCNE1CDK2 | |
| SCHEMBL28696412 | 0.89 | EGFR (0.66) | EGFRCDK4CCND1CCNE1CDK2 | |
| SCHEMBL29368349 | 0.89 | EGFR (0.66) | EGFRCDK4CCND1CCNE1CDK2 | |
| SCHEMBL29370824 | 0.89 | EGFR (0.66) | EGFRCDK4CCND1CCNE1CDK2 | |
| SCHEMBL18376646 | 0.89 | EGFR (0.66) | EGFRCDK4CCND1CCNE1CDK2 | |
| SCHEMBL18376854 | 0.88 | EGFR (0.63) | EGFRCDK4CCND1CCNE1CDK2 | |
| SCHEMBL18376766 | 0.88 | EGFR (0.57) | EGFRCDK4CCND1CCNE1CDK2 | |
| SCHEMBL29576513 | 0.88 | EGFR (0.72) | EGFRCDK4CCND1CCNE1CDK2 |
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 |