Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.48 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.46 |
| ▸ | ELANE | P08246 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 3/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.39 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6654304 | 0.92 | SPHK1 (0.43) | ALDH1A1SMN1; SMN2SPHK1SPHK2ELANE | |
| SCHEMBL7016050 | 0.87 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2KDM4EMAPK1HTT | |
| SCHEMBL7016053 | 0.87 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2KDM4EMAPK1HTT | |
| SCHEMBL6417166 | 0.84 | L3MBTL1 (0.46) | SPHK1SPHK2ELANEHTTSCN3A | |
| SCHEMBL8911799 | 0.82 | LTA4H (0.49) | ALDH1A1SMN1; SMN2KDM4EMAPK1HTT | |
| SCHEMBL7026294 | 0.82 | LTA4H (0.49) | ALDH1A1SMN1; SMN2KDM4EMAPK1HTT | |
| Hydrochloric Acid SCHEMBL5941225 | 0.81 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2KDM4EMAPK1HTT | |
| Trifluoroacetic Acid SCHEMBL6658125 | 0.80 | AKR1C3 (0.40) | SPHK1SPHK2SCN3ASCN9A | |
| SCHEMBL18474160 | 0.79 | DPP4 (0.45) | ALDH1A1SMN1; SMN2SPHK1SPHK2ELANE | |
| SCHEMBL18474217 | 0.79 | DPP4 (0.45) | ALDH1A1SMN1; SMN2SPHK1SPHK2ELANE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1434580-A2 | ALLYLAMIDES USEFUL IN THE TREATMENT OF ALZHEIMER'S DISEASE | Elan Pharmaceuticals, Inc. (US) | 2004-07-07 | — | — | EP | disclosed |
| WO-2003030886-A2 | ALLYLAMIDES USEFUL IN THE TREATMENT OF ALZHEIMER'S DISEASE | ELAN PHARMACEUTICALS, INC (US) | 2003-04-17 | — | — | WO | disclosed |