Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 2/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.44 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.37 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.37 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.37 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.37 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.37 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.37 |
| ▸ | MAT2A | P31153 | 1/20 | 0.36 |
| ▸ | TDP2 | O95551 | 3/20 | 0.36 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 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 | |
|---|---|---|---|---|
| SCHEMBL6581649 | 0.85 | NR1H2 (0.51) | NR1H2NR1H3RAB9ANPC1HSD17B2 | |
| SCHEMBL6581289 | 0.83 | DRD1 (0.46) | NR1H2NR1H3RAB9ANPC1HSD17B2 | |
| SCHEMBL6580791 | 0.81 | TNK2 (0.43) | NR1H2NR1H3RAB9ANPC1HSD17B2 | |
| Hydrochloric Acid SCHEMBL6583998 | 0.80 | TNK2 (0.42) | NR1H2NR1H3RAB9ANPC1HSD17B2 | |
| SCHEMBL17279740 | 0.71 | NR1H3 (0.82) | NR1H2NR1H3RAB9ANPC1HSD17B2 | |
| SCHEMBL6582815 | 0.69 | NR1H3 (0.47) | NR1H2NR1H3RAB9ANPC1ADORA1 | |
| SCHEMBL6580839 | 0.68 | KDM4C (0.49) | NR1H2NR1H3RAB9ANPC1HSD17B2 | |
| SCHEMBL8265098 | 0.67 | PPARG (0.56) | HSD17B2NPSR1ALDH1A1GAA | |
| SCHEMBL16202050 | 0.67 | ALDH1A1 (0.43) | RAB9ANPC1ADORA2AADORA1F2RL3 | |
| SCHEMBL6581328 | 0.67 | NR1H3 (0.45) | NR1H2NR1H3RAB9ANPC1ADORA1 |
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 |