Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 4/20 | 0.50 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.50 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | LCK | P06239 | 2/20 | 0.45 |
| ▸ | BTK | Q06187 | 2/20 | 0.45 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.43 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.43 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.43 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.43 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.43 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6582892 | 0.86 | ADORA2A (0.41) | NR1H2NR1H3ADORA2AADORA1LCK | |
| SCHEMBL6578586 | 0.86 | S1PR1 (0.44) | NR1H2NR1H3ADORA2AADORA1LCK | |
| SCHEMBL6581439 | 0.85 | NR1H2 (0.52) | NR1H2NR1H3ADORA2AADORA1KDM4E | |
| SCHEMBL6578742 | 0.81 | NR1H2 (0.67) | NR1H2NR1H3ADORA2AADORA1KDM4E | |
| SCHEMBL6580942 | 0.81 | HTR7 (0.46) | NR1H2NR1H3ADORA2AADORA1KDM4E | |
| Hydrochloric Acid SCHEMBL6581027 | 0.80 | HTR7 (0.46) | NR1H2NR1H3ADORA2AADORA1KDM4E | |
| SCHEMBL28095606 | 0.80 | KDM4E (0.55) | NR1H2NR1H3ADORA2AADORA1KDM4E | |
| SCHEMBL6580708 | 0.79 | ADORA2A (0.44) | NR1H2NR1H3ADORA2AADORA1KDM4E | |
| SCHEMBL6578503 | 0.78 | ADORA2A (0.62) | NR1H2NR1H3ADORA2AADORA1LCK | |
| Hydrochloric Acid SCHEMBL6582961 | 0.77 | ADORA2A (0.61) | NR1H2NR1H3ADORA2AADORA1LCK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1070708-B1 | Triazole derivatives | HOFFMANN LA ROCHE (CH) | 2004-01-14 | — | — | EP | claimed |