Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10637869 | 0.85 | ALDH1A1 (0.46) | ALDH1A1TDP1PTGS2RAD52SLC18A3 | |
| SCHEMBL3101732 | 0.84 | TDP1 (0.48) | ALDH1A1TDP1MAPTCYP3A4L3MBTL1 | |
| SCHEMBL26454803 | 0.82 | ALDH1A1 (0.43) | ALDH1A1TDP1PTGS2RAD52SLC18A3 | |
| SCHEMBL10886715 | 0.82 | ALDH1A1 (0.43) | ALDH1A1TDP1PTGS2RAD52SLC18A3 | |
| SCHEMBL4661264 | 0.81 | THRB (0.51) | ALDH1A1TDP1MAPTCYP3A4L3MBTL1 | |
| SCHEMBL4623580 | 0.80 | HCAR2 (0.40) | ALDH1A1TDP1MAPTKDM4E | |
| SCHEMBL9243898 | 0.79 | MAPT (0.49) | ALDH1A1RAD52MAPTSLC18A3MEN1 | |
| SCHEMBL9244072 | 0.77 | ALDH1A1 (0.48) | ALDH1A1PTGS2RAD52MAPTSLC18A3 | |
| SCHEMBL4661594 | 0.75 | DUT (0.36) | — | |
| SCHEMBL11369938 | 0.75 | HDAC3 (0.47) | ALDH1A1MAPTTSHRMAPK1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-4139403-A | Dinitroalkyl and fluorodinitroalkyl silicon compounds | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1979-02-13 | — | — | US | disclosed |