Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.38 |
| ▸ | PTK6 | Q13882 | 7/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | FBP1 | P09467 | 1/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | P2RY4 | P51582 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL26679821 | 0.99 | APP (0.41) | APPNR4A2TNNI3KPTGS1PTK6 | |
| SCHEMBL24600519 | 0.89 | TNNI3K (0.40) | APPNR4A2TNNI3KPTGS1PTK6 | |
| Hydrochloric Acid SCHEMBL26679851 | 0.88 | TNNI3K (0.40) | APPNR4A2TNNI3KPTGS1PTK6 | |
| SCHEMBL24600663 | 0.85 | APP (0.44) | APPNR4A2TNNI3KPTGS1PTK6 | |
| Hydrochloric Acid SCHEMBL30546664 | 0.83 | APP (0.43) | APPNR4A2TNNI3KPTGS1PTK6 | |
| Hydrochloric Acid SCHEMBL26679816 | 0.83 | APP (0.43) | APPNR4A2TNNI3KPTGS1PTK6 | |
| SCHEMBL24600522 | 0.82 | APP (0.41) | APPNR4A2TNNI3KPTGS1PTK6 | |
| Hydrochloric Acid SCHEMBL30546633 | 0.81 | APP (0.40) | APPNR4A2TNNI3KPTGS1PTK6 | |
| Hydrochloric Acid SCHEMBL26679845 | 0.81 | APP (0.40) | APPNR4A2TNNI3KPTGS1PTK6 | |
| Hydrochloric Acid SCHEMBL29691542 | 0.81 | TNNI3K (0.39) | APPNR4A2TNNI3KPTGS1PTK6 |
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-2022146022-A1 | NOVEL NAPHTHYRIDINONE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE AND USE THEREOF | 주식회사 티씨노바이오사이언스 | 2022-07-07 | — | — | WO | disclosed |