Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 2/20 | 0.49 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.49 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 4/20 | 0.46 |
| ▸ | CA2 | P00918 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.43 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.43 |
| ▸ | ANPEP | P15144 | 1/20 | 0.41 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.38 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31457372 | 1.00 | CLK1 (0.49) | CLK1DYRK1ANCOA3CA1CA2 | |
| SCHEMBL8955230 | 0.82 | DYRK1A (0.45) | CLK1DYRK1ANCOA3CA1CA2 | |
| SCHEMBL10338293 | 0.82 | KDM4E (0.59) | CLK1DYRK1ANCOA3CA1CA2 | |
| SCHEMBL3961346 | 0.82 | DYRK1A (0.45) | CLK1DYRK1ANCOA3CA1CA2 | |
| SCHEMBL7307452 | 0.82 | CA1 (0.46) | CLK1DYRK1ANCOA3CA1CA2 | |
| SCHEMBL10829252 | 0.82 | CLK1 (0.45) | CLK1DYRK1ANCOA3CA1CA2 | |
| SCHEMBL11845987 | 0.82 | KDM4E (0.47) | CLK1DYRK1ANCOA3CA1CA2 | |
| SCHEMBL9453843 | 0.82 | CLK1 (0.45) | CLK1DYRK1ANCOA3CA1CA2 | |
| SCHEMBL32211 | 0.82 | ALDH1A1 (0.58) | CLK1DYRK1ANCOA3CA1CA2 | |
| SCHEMBL29391266 | 0.82 | ALDH1A1 (0.58) | CLK1DYRK1ANCOA3CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109283770-A | Naphthalene phthalocyanine-graphene oxide composite non-linear optical material and preparation method thereof | 黑龙江大学 | 2019-01-29 | — | — | CN | disclosed |