Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.42 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 3/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2759682 | 0.97 | CYP1A1 (0.45) | ESR1ESR2CYP1A1CYP1B1MAPT | |
| SCHEMBL2759678 | 0.97 | ESR1 (0.41) | ESR1ESR2CYP1A1CYP1B1MAPT | |
| SCHEMBL2759684 | 0.97 | ESR1 (0.41) | ESR1ESR2CYP1A1CYP1B1MAPT | |
| SCHEMBL2759670 | 0.97 | ESR1 (0.41) | ESR1ESR2CYP1A1CYP1B1MAPT | |
| SCHEMBL2759699 | 0.97 | CYP1A1 (0.45) | ESR1ESR2CYP1A1CYP1B1MAPT | |
| SCHEMBL2759672 | 0.92 | CYP1A2 (0.41) | ESR1ESR2CYP1A1CYP1B1MAPT | |
| SCHEMBL2759695 | 0.90 | CYP1A2 (0.40) | ESR1ESR2CYP1A1CYP1B1MAPT | |
| SCHEMBL2759671 | 0.90 | CYP1A2 (0.40) | ESR1ESR2CYP1A1CYP1B1MAPT | |
| SCHEMBL812484 | 0.90 | ESR1 (0.53) | ESR1ESR2MAPTTP53CYP1A2 | |
| SCHEMBL2759685 | 0.89 | CYP1A2 (0.38) | ESR1ESR2CYP1A1CYP1B1MAPT |
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-8674347-B2 | Organic semiconductor material and organic thin-film transistor | KYUSHU INSTITUTE OF TECHNOLOGY (JP) | 2014-03-18 | — | — | US | disclosed |
| US-20120001162-A1 | ORGANIC SEMICONDUCTOR MATERIAL AND ORGANIC THIN-FILM TRANSISTOR | KYUSHU INSTITUTE OF TECHNOLOGY (JP) | 2012-01-05 | — | — | US | disclosed |