Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | MGLL | Q99685 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12817707 | 0.81 | POLB (0.42) | ADRB1MGLLALDH1A1MAPTDRD2 | |
| SCHEMBL29833216 | 0.77 | MAPT (0.46) | ALDH1A1CYP3A4MAPTCA1CA2 | |
| SCHEMBL28859449 | 0.76 | MGLL (0.41) | MGLLALDH1A1NPC1ALOX5MEN1 | |
| SCHEMBL28171948 | 0.76 | FAAH (0.41) | MGLLALDH1A1MAPTNOTUMALOX5 | |
| 1,4-Dimethoxybenzene SCHEMBL29217234 | 0.75 | GAA (0.45) | ALDH1A1CYP3A4MAPTNPC1CA1 | |
| SCHEMBL2049800 | 0.74 | MAPT (0.33) | ADRB1CYP3A4MAPTNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL29103226 | 0.72 | NPC1 (0.35) | ADRB1MAPTNPC1RAB9AMEN1 | |
| Hydrochloric Acid SCHEMBL28920941 | 0.72 | NPC1 (0.35) | ADRB1MAPTNPC1RAB9AMEN1 | |
| SCHEMBL4140323 | 0.72 | MAPT (0.32) | ADRB1MAPTNPC1RAB9AMEN1 | |
| Water SCHEMBL28778724 | 0.72 | MAPT (0.32) | ADRB1MAPTNPC1RAB9AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103119028-B | 1,2,4-triazolone derivative | TAISHO PHARMACEUTICAL CO.,LTD. (JP) | 2016-05-25 | — | — | CN | disclosed |