Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CD44 | P16070 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.32 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2608093 | 0.82 | TSHR (0.33) | ALDH1A1TSHRCA1CA2 | |
| SCHEMBL27931079 | 0.81 | ALDH1A1 (0.44) | ALDH1A1CYP1A2CYP2A6CD44MAPK1 | |
| SCHEMBL19995979 | 0.81 | ALDH1A1 (0.33) | ALDH1A1TSHRCYP3A4TDP1 | |
| SCHEMBL17672254 | 0.77 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP2A6CD44TRPA1 | |
| SCHEMBL25426139 | 0.76 | ALDH1A1 (0.39) | ALDH1A1CYP1A2CYP2A6CD44MAPK1 | |
| SCHEMBL4021982 | 0.76 | ACHE (0.57) | ALDH1A1CYP1A2CYP2A6CD44TRPA1 | |
| SCHEMBL4537402 | 0.74 | ALDH1A1 (0.60) | ALDH1A1CYP1A2CYP2A6CD44MAPK1 | |
| SCHEMBL25611928 | 0.73 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP2A6CD44MAPK1 | |
| SCHEMBL11552812 | 0.69 | ACHE (0.45) | ALDH1A1CYP1A2CYP2A6CD44TSHR | |
| SCHEMBL264714 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008089314-A1 | FLAME RETARDANT POLY (ARLENE ETHER) COMPOSITIONS AND ARTICLES | SABIC INNOVATIVE PLASTICS IP B.V. (NL) | 2008-07-24 | — | — | WO | disclosed |
| WO-2008036454-A1 | POLY (ARYLENE ETHER) COPOLYMER | SABIC INNOVATIVE PLASTICS IP B.V. (NL) | 2008-03-27 | — | — | WO | disclosed |