Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.36 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.36 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.36 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.36 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.36 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL16234268 | 0.81 | ALDH1A1 (0.59) | ALDH1A1MAPTL3MBTL1KCNH3HTR2A | |
| SCHEMBL10606669 | 0.80 | ALDH1A1 (0.57) | ALDH1A1MAPTL3MBTL1KCNH3HTR2A | |
| SCHEMBL2255790 | 0.77 | ALDH1A1 (0.64) | ALDH1A1MAPTL3MBTL1KCNH3HTR2A | |
| SCHEMBL28681649 | 0.76 | ALDH1A1 (0.57) | ALDH1A1MAPTL3MBTL1KCNH3HTR2A | |
| SCHEMBL11046087 | 0.75 | ALDH1A1 (0.55) | ALDH1A1MAPTL3MBTL1KCNH3HTR2A | |
| SCHEMBL11040887 | 0.75 | ALDH1A1 (0.55) | ALDH1A1MAPTL3MBTL1KCNH3SMN1; SMN2 | |
| SCHEMBL11350829 | 0.75 | ALDH1A1 (0.50) | ALDH1A1MAPTKCNH3KDM4ENPSR1 | |
| SCHEMBL20318842 | 0.75 | ALDH1A1 (0.50) | ALDH1A1MAPTL3MBTL1KCNH3CYP1A2 | |
| SCHEMBL49577 | 0.74 | ALDH1A1 (0.73) | ALDH1A1MAPTL3MBTL1KCNH3KDM4E | |
| SCHEMBL9572773 | 0.74 | MAPT (0.59) | ALDH1A1MAPTL3MBTL1KCNH3HTR2A |
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-1175246-A | Substituted azetidin-2-ones for treatment of atherosclerosis | SMITHKLINE BEECHAM PLC (GB) | 1998-03-04 | — | — | CN | disclosed |