Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1309905 | 0.84 | CYP3A4 (0.58) | CYP3A4TDP1ALDH1A1TSHRGFER | |
| SCHEMBL54121 | 0.82 | — | — | |
| SCHEMBL9330651 | 0.82 | CYP3A4 (0.59) | CYP3A4TDP1ALDH1A1TSHRGFER | |
| SCHEMBL28175406 | 0.81 | LOXL2 (0.65) | CYP3A4TDP1ALDH1A1TSHRGFER | |
| SCHEMBL9821744 | 0.79 | CYP3A4 (0.56) | CYP3A4TDP1ALDH1A1TSHRGFER | |
| Hydrochloric Acid SCHEMBL864912 | 0.79 | ALDH1A1 (0.55) | CYP3A4TDP1ALDH1A1TSHRGFER | |
| SCHEMBL6020612 | 0.79 | CYP3A4 (0.62) | CYP3A4TDP1ALDH1A1TSHRGFER | |
| Methyl Alcohol SCHEMBL28089962 | 0.77 | TSHR (0.52) | CYP3A4TDP1ALDH1A1TSHRGFER | |
| SCHEMBL398262 | 0.75 | MAOB (0.37) | CYP3A4TDP1ALDH1A1TSHRGFER | |
| SCHEMBL7261403 | 0.73 | TOP1 (0.65) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2408572-A1 | COMPOSITE STRUCTURED ORGANIC FILMS | Xerox Corporation (US) | 2012-01-25 | — | — | EP | disclosed |
| EP-2403656-A1 | ELECTRONIC DEVICES COMPRISING STRUCTURED ORGANIC FILMS | Xerox Corporation (US) | 2012-01-11 | — | — | EP | disclosed |
| WO-2010102038-A1 | ELECTRONIC DEVICES COMPRISING STRUCTURED ORGANIC FILMS | XEROX CORPORATION (US) | 2010-09-10 | — | — | WO | disclosed |
| WO-2010102027-A1 | COMPOSITE STRUCTURED ORGANIC FILMS | XEROX CORPORATION (US) | 2010-09-10 | — | — | WO | disclosed |