Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| O-Xylene SCHEMBL1362988 | 0.97 | ACHE (0.67) | ACHETSHRALDH1A1CA1CA2 | |
| O-Xylene SCHEMBL28178099 | 0.94 | TSHR (0.62) | ACHETSHRALDH1A1CA1CA2 | |
| O-Xylene SCHEMBL29076810 | 0.88 | ACHE (0.62) | ACHETSHRALDH1A1CA1CA2 | |
| O-Xylene SCHEMBL29187586 | 0.86 | LMNA (0.58) | ACHETSHRALDH1A1CA1CA2 | |
| O-Xylene SCHEMBL28550267 | 0.85 | TSHR (0.59) | ACHETSHRALDH1A1CA1CA2 | |
| O-Xylene SCHEMBL28363857 | 0.84 | CA12 (0.55) | ACHETSHRALDH1A1CA1CA2 | |
| O-Xylene SCHEMBL9663051 | 0.83 | TSHR (0.91) | ACHETSHRALDH1A1CA1CA2 | |
| O-Xylene SCHEMBL11403331 | 0.80 | ACHE (0.53) | ACHETSHRALDH1A1TDP1CYP1A2 | |
| O-Xylene SCHEMBL3794640 | 0.80 | ACHE (0.53) | ACHETSHRALDH1A1CA1CA2 | |
| Orthocresol SCHEMBL29060427 | 0.80 | TRPA1 (0.50) | ACHETSHRALDH1A1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4296019-A | Solvent blends for ethylene copolymers | THE DOW CHEMICAL CO. (US) | 1981-10-20 | — | — | US | disclosed |
| US-4279797-A | ALCOHOL, AROMATIC HYDROCARBON, AND HALOGENATED HYDROCARBON | THE DOW CHEMICAL COMPANY (US) | 1981-07-21 | — | — | US | disclosed |