Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.50 |
| ▸ | CDC25A | P30304 | 1/20 | 0.50 |
| ▸ | CDC25B | P30305 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA7 | P43166 | 3/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22989 | 0.91 | CYP1A2 (0.61) | CYP1A2HSD17B10CDC25ACDC25BALDH1A1 | |
| SCHEMBL29445717 | 0.91 | CYP1A2 (0.61) | CYP1A2HSD17B10CDC25ACDC25BALDH1A1 | |
| SCHEMBL1988762 | 0.91 | CYP1A2 (0.61) | CYP1A2HSD17B10CDC25ACDC25BALDH1A1 | |
| SCHEMBL8879805 | 0.88 | CYP1A2 (0.58) | CYP1A2HSD17B10CDC25ACDC25BALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL5023112 | 0.88 | CYP1A2 (0.58) | CYP1A2HSD17B10CDC25ACDC25BALDH1A1 | |
| Hydrochloric Acid SCHEMBL18124413 | 0.88 | CYP1A2 (0.58) | CYP1A2HSD17B10CDC25ACDC25BALDH1A1 | |
| SCHEMBL5550251 | 0.88 | CYP1A2 (0.58) | CYP1A2HSD17B10CDC25ACDC25BALDH1A1 | |
| Hydrochloric Acid SCHEMBL10351177 | 0.88 | CYP1A2 (0.58) | CYP1A2HSD17B10CDC25ACDC25BALDH1A1 | |
| Mellitic Acid SCHEMBL2426221 | 0.88 | CYP1A2 (0.58) | CYP1A2HSD17B10CDC25ACDC25BALDH1A1 | |
| SCHEMBL28383247 | 0.88 | CYP1A2 (0.58) | CYP1A2HSD17B10CDC25ACDC25BALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20200148827-A1 | TWO-DIMENSIONAL POLYMERS COMPRISED OF A COMBINATION OF STIFF AND COMPLIANT MOLECULAR UNITS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY | 2020-05-14 | — | — | US | disclosed |
| US-10590241-B2 | Two-dimensional polymers comprised of a combination of stiff and compliant molecular units | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) | 2020-03-17 | — | — | US | disclosed |
| US-20170240706-A1 | TWO-DIMENSIONAL POLYMERS COMPRISED OF A COMBINATION OF STIFF AND COMPLIANT MOLECULAR UNITS | ARMY, UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE | 2017-08-24 | — | — | US | disclosed |