Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C4 | P17516 | 2/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.50 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.50 |
| ▸ | LCK | P06239 | 1/20 | 0.46 |
| ▸ | FYN | P06241 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA3 | P07451 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.45 |
| ▸ | TTR | P02766 | 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 | |
|---|---|---|---|---|
| SCHEMBL4626489 | 0.97 | AKR1C4 (0.52) | AKR1C4AKR1C3AKR1C2AKR1C1LCK | |
| SCHEMBL17890434 | 0.86 | LCK (0.56) | AKR1C4AKR1C3AKR1C2AKR1C1LCK | |
| SCHEMBL71146 | 0.85 | LCK (0.60) | AKR1C4AKR1C3AKR1C2AKR1C1LCK | |
| SCHEMBL710220 | 0.83 | LCK (0.48) | AKR1C4AKR1C3AKR1C2AKR1C1LCK | |
| SCHEMBL11706863 | 0.82 | LCK (0.58) | AKR1C4AKR1C3AKR1C2AKR1C1LCK | |
| SCHEMBL31169213 | 0.81 | AKR1C4 (0.50) | AKR1C4AKR1C3AKR1C2AKR1C1LCK | |
| SCHEMBL9478732 | 0.81 | AKR1C4 (0.50) | AKR1C4AKR1C3AKR1C2AKR1C1PTPN1 | |
| Pyromellitic Acid SCHEMBL9485109 | 0.81 | ALDH1A1 (0.50) | AKR1C4AKR1C3AKR1C2AKR1C1CA12 | |
| Pyromellitic Acid SCHEMBL27895070 | 0.81 | ALDH1A1 (0.50) | AKR1C4AKR1C3AKR1C2AKR1C1CA12 | |
| Ethylene SCHEMBL11741498 | 0.80 | LCK (0.56) | AKR1C4AKR1C3AKR1C2AKR1C1LCK |
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-105541850-B | A kind of phthalocyanine-like compound and its synthetic method and application | 京东方科技集团股份有限公司 | 2018-05-15 | — | — | CN | disclosed |