Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.55 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.55 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.55 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | DRD4 | P21917 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | DHPS | P49366 | 2/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4107305 | 0.82 | KDM4E (0.66) | ALDH1A1ROCK2LMNAMAPK1DHPS | |
| SCHEMBL29175354 | 0.77 | LMNA (0.49) | ALDH1A1LMNAHDAC3HDAC1MAPT | |
| SCHEMBL7442891 | 0.77 | ALDH1A1 (0.53) | ALDH1A1LMNAMAPK1DHPSKDM4E | |
| SCHEMBL25120814 | 0.76 | DHPS (0.57) | MAPK1DHPSTRPV1HDAC3HDAC1 | |
| SCHEMBL4865366 | 0.76 | MAPK1 (0.56) | ALDH1A1LMNAMAPK1DHPSTRPV1 | |
| SCHEMBL7447586 | 0.76 | DRD4 (0.60) | DRD2DRD4DRD3MAPK1GAA | |
| SCHEMBL4025098 | 0.76 | MAPK1 (0.63) | MAPK1DHPSTRPV1 | |
| SCHEMBL29901215 | 0.76 | MAPK1 (0.63) | MAPK1DHPSTRPV1 | |
| SCHEMBL29175327 | 0.75 | PTGS2 (0.52) | ALDH1A1LMNAHDAC3HDAC1NPC1 | |
| SCHEMBL257380 | 0.74 | MAPK1 (0.71) | ALDH1A1MAPK1DHPSTRPV1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6228880-B1 | PARKINSON*S DISEASE, TOURETTE*S SYNDROME, SCHIZOPHRENIA, ALCOHOLISM, DRUG ABUSE; SIDE EFFECT REDUCTION | AMERICAN HOME PRODUCTS CORP | 2001-05-08 | — | — | US | disclosed |
| EP-1073636-A1 | 4-AMINO-(ETHYLAMINO)-OXINDOLE DOPAMINE AUTORECEPTOR AGONISTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-02-07 | — | — | EP | disclosed |
| WO-1999052870-A1 | 4-AMINO-(ETHYLAMINO)-OXINDOLE DOPAMINE AUTORECEPTOR AGONISTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-10-21 | — | — | WO | disclosed |