Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | P4HB | P07237 | 1/20 | 0.34 |
| ▸ | SMAD3 | P84022 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11461742 | 1.00 | ACHE (0.40) | ACHETSHRPABPC1HIF1AALDH1A1 | |
| SCHEMBL11468632 | 0.75 | PABPC1 (0.38) | TSHRPABPC1ALDH1A1MAPK1SMN1; SMN2 | |
| SCHEMBL11461117 | 0.73 | GRM5 (0.33) | TSHRPABPC1 | |
| SCHEMBL10757621 | 0.65 | ACHE (0.46) | ACHETSHRHIF1AALDH1A1RAB9A | |
| SCHEMBL10757640 | 0.65 | ACHE (0.46) | ACHETSHRHIF1AALDH1A1RAB9A | |
| SCHEMBL13955907 | 0.62 | PPARG (0.55) | ACHETSHRALDH1A1RAB9APPARG | |
| SCHEMBL84033 | 0.61 | PPARG (0.53) | ACHEALDH1A1PPARGPPARDPPARA | |
| SCHEMBL22420289 | 0.60 | NPC1 (0.54) | ACHEHIF1ARAB9AHTTSMN1; SMN2 | |
| SCHEMBL8909353 | 0.60 | PPARG (0.52) | ACHETSHRALDH1A1RAB9APPARG | |
| SCHEMBL8859133 | 0.60 | PPARG (0.52) | ACHETSHRALDH1A1RAB9APPARG |
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-4181661-A | SCHIZOPHRENIA, PSYCHOLOGICAL DISORDERS | MERCK & CO., INC. (US) | 1980-01-01 | — | — | US | disclosed |