Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 1/20 | 0.52 |
| ▸ | BRAF | P15056 | 1/20 | 0.52 |
| ▸ | ERBB2 | P04626 | 12/20 | 0.51 |
| ▸ | EGFR | P00533 | 11/20 | 0.51 |
| ▸ | ERBB3 | P21860 | 2/20 | 0.50 |
| ▸ | ERBB4 | Q15303 | 2/20 | 0.50 |
| ▸ | FECH | P22830 | 2/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.47 |
| ▸ | MYH14 | Q7Z406 | 1/20 | 0.47 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CDK8 | P49336 | 1/20 | 0.45 |
| ▸ | MAP2K5 | Q13163 | 1/20 | 0.45 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.45 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.45 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.44 |
| ▸ | NCOA3 | Q9Y6Q9 | 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 | |
|---|---|---|---|---|
| SCHEMBL22200858 | 0.85 | EGFR (0.61) | ERBB2EGFRERBB4 | |
| SCHEMBL12872982 | 0.80 | ERBB2 (0.54) | RAF1BRAFERBB2EGFRERBB3 | |
| SCHEMBL22076856 | 0.78 | EGFR (0.47) | ERBB2EGFRFECHCDK8MAP2K5 | |
| SCHEMBL15431012 | 0.78 | ERBB2 (0.46) | RAF1BRAFERBB2EGFRERBB3 | |
| SCHEMBL20780984 | 0.77 | ERBB2 (0.59) | ERBB2EGFRERBB3ERBB4FECH | |
| SCHEMBL29025871 | 0.77 | EGFR (0.68) | ERBB2EGFR | |
| SCHEMBL20780840 | 0.77 | EGFR (0.68) | ERBB2EGFR | |
| SCHEMBL24832693 | 0.75 | ERBB2 (0.68) | ERBB2EGFRERBB3ERBB4FECH | |
| SCHEMBL24569983 | 0.75 | HTT (0.62) | ERBB2EGFRERBB3ERBB4FECH | |
| SCHEMBL24569330 | 0.74 | ERBB2 (0.67) | ERBB2EGFRERBB3ERBB4FECH |
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-2019042409-A1 | NITROGENOUS HETEROCYCLIC COMPOUND, PREPARATION METHOD, INTERMEDIATE, COMPOSITION, AND APPLICATION | 上海医药集团股份有限公司 | 2019-03-07 | — | — | WO | disclosed |