Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.46 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.44 |
| ▸ | CTSG | P08311 | 1/20 | 0.43 |
| ▸ | CMA1 | P23946 | 1/20 | 0.43 |
| ▸ | VCP | P55072 | 2/20 | 0.43 |
| ▸ | AGXT | P21549 | 2/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.42 |
| ▸ | GFER | P55789 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | CCR3 | P51677 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14172860 | 0.88 | RAB9A (0.51) | ALDH1A1GAAMAPTLMNASMN1; SMN2 | |
| SCHEMBL15709650 | 0.85 | PRMT6 (0.56) | ALDH1A1GAAMAPTLMNASMN1; SMN2 | |
| SCHEMBL15709874 | 0.85 | MAPT (0.53) | ALDH1A1GAAMAPTLMNASMN1; SMN2 | |
| SCHEMBL20425051 | 0.84 | CTSG (0.46) | ALDH1A1GAAMAPTLMNASMN1; SMN2 | |
| SCHEMBL15725249 | 0.84 | PRMT6 (0.58) | ALDH1A1GAAMAPTLMNASMN1; SMN2 | |
| SCHEMBL17557742 | 0.84 | MAPT (0.55) | ALDH1A1GAAMAPTLMNASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL17557618 | 0.83 | MAPT (0.54) | ALDH1A1GAAMAPTLMNASMN1; SMN2 | |
| SCHEMBL29589898 | 0.83 | AGXT (0.58) | ALDH1A1GAAMAPTLMNASMN1; SMN2 | |
| SCHEMBL15710135 | 0.83 | AGXT (0.58) | ALDH1A1GAAMAPTLMNASMN1; SMN2 | |
| SCHEMBL15033043 | 0.82 | SIGMAR1 (0.51) | ALDH1A1MAPTSLC7A5KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008071587-A2 | 2-(PIPERIDIN-4-YL)-4-PHENOXY- OR PHENYLAMINO-PYRIMIDINE DERIVATIVES AS NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-06-19 | — | — | WO | disclosed |