Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | AGXT | P21549 | 2/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL45693 | 0.85 | ACHE (0.56) | ACHECA1CA2CA7CA9 | |
| SCHEMBL2913883 | 0.80 | ACHE (0.45) | ACHEALDH1A1CHRM2CHRM1CHRM3 | |
| SCHEMBL9605247 | 0.79 | ACHE (0.58) | ACHECA1CA2CA7CA9 | |
| SCHEMBL4676751 | 0.79 | CHRM2 (0.40) | ACHECA1CA2CA7CA9 | |
| SCHEMBL18644113 | 0.75 | CA1 (0.50) | ACHECA1CA2CA7CA9 | |
| SCHEMBL10076569 | 0.74 | ACHE (0.46) | ACHEALDH1A1CYP3A4TAAR1IDO1 | |
| 1,3-Dimethoxybenzene SCHEMBL28262290 | 0.73 | ACHE (0.67) | ACHECA1CA2CA7CA9 | |
| SCHEMBL6600795 | 0.73 | ACHE (0.45) | ACHECA1CA2CA7CA9 | |
| SCHEMBL4612908 | 0.72 | ACHE (0.41) | ACHE | |
| SCHEMBL4611923 | 0.72 | ACHE (0.71) | ACHECA1CA2CA7CA9 |
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-9601696-B2 | Electroluminescent composition and electric device with high brightness | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-03-21 | — | — | US | disclosed |