Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 5/20 | 0.38 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28645731 | 0.96 | LCK (0.41) | LCKFYNS1PR3ESR1AKR1C4 | |
| Tetrabuthylammonium SCHEMBL28638749 | 0.92 | LCK (0.50) | LCKFYNS1PR3PLA2G2A | |
| SCHEMBL28649465 | 0.91 | LCK (0.36) | LCKFYNS1PR3CNR2 | |
| SCHEMBL28643767 | 0.89 | LCK (0.39) | LCKFYNS1PR3ESR1CNR2 | |
| Tetrylammonium SCHEMBL28646752 | 0.89 | LCK (0.47) | LCKFYNS1PR3ESR1SERPINE1 | |
| SCHEMBL28641662 | 0.88 | LCK (0.38) | LCKFYNS1PR3ESR1CNR2 | |
| Di(Hydroxyethyl)Ether SCHEMBL28645732 | 0.88 | LCK (0.48) | LCKFYNS1PR3PLA2G2A | |
| SCHEMBL8083912 | 0.88 | LCK (0.56) | LCKFYNSERPINE1 | |
| Di(Hydroxyethyl)Ether SCHEMBL27917913 | 0.86 | LCK (0.51) | LCKFYNS1PR3ESR1AKR1C4 | |
| SCHEMBL28300356 | 0.84 | SERPINE1 (0.44) | LCKFYNESR1AKR1C4AKR1C3 |
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-112831042-A | Antistatic polyester composition, preparation method thereof and polyester film | 东丽纤维研究所（中国）有限公司 | 2021-05-25 | — | — | CN | disclosed |