Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.32 |
| ▸ | CD44 | P16070 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10912630 | 0.85 | TRPA1 (0.42) | TRPA1ATMCYP2A6CYP1A2TSHR | |
| SCHEMBL31258279 | 0.79 | TSHR (0.47) | CYP2A6CYP1A2TSHRACHEALDH1A1 | |
| SCHEMBL29706026 | 0.79 | TRPA1 (0.46) | TRPA1ATMCYP2A6CYP1A2TSHR | |
| SCHEMBL29653622 | 0.79 | TRPA1 (0.46) | TRPA1ATMCYP2A6CYP1A2TSHR | |
| SCHEMBL541710 | 0.79 | TSHR (0.47) | CYP2A6CYP1A2TSHRACHEALDH1A1 | |
| SCHEMBL126302 | 0.79 | TRPA1 (0.46) | TRPA1ATMCYP2A6CYP1A2TSHR | |
| SCHEMBL17473168 | 0.77 | TRPA1 (0.44) | TRPA1ATMCYP2A6CYP1A2TSHR | |
| SCHEMBL4255726 | 0.77 | TRPA1 (0.44) | TRPA1ATMCYP2A6CYP1A2TSHR | |
| Bromide SCHEMBL29142559 | 0.77 | TRPA1 (0.44) | TRPA1ATMCYP2A6CYP1A2TSHR | |
| SCHEMBL10713133 | 0.77 | TRPA1 (0.44) | TRPA1ATMCYP2A6CYP1A2TSHR |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9640767-B1 | Electronic device including phosphine oxide functionalized triazine derivative and novel phosphine oxide functionalized triazine derivative | PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) | 2017-05-02 | — | — | US | disclosed |
| US-9640767-B1 | Electronic device including phosphine oxide functionalized triazine derivative and novel phosphine oxide functionalized triazine derivative | PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) | 2017-05-02 | — | — | US | disclosed |
| US-4482748-A | Hydrocarbonylation | CELANESE CORPORATION (US) | 1984-11-13 | — | — | US | disclosed |
| US-4267383-A | USING A COMPLEX CATALYST FROM A TRIARYL PHOSPHINE AND A RHODIUM CARBONYL HYDRIDE OR CHLORIDE | CELANESE CORPORATION (US) | 1981-05-12 | — | — | US | disclosed |
| US-4110404-A | Hydrocarbonylation | CELANESE CORPORATION (US) | 1978-08-29 | — | — | US | disclosed |
| US-3965192-A | Hydrocarbonylation process | UNION OIL COMPANY OF CALIFORNIA (US) | 1976-06-22 | — | — | US | disclosed |