Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 3/20 | 0.53 |
| ▸ | TDP2 | O95551 | 3/20 | 0.52 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | GRM5 | P41594 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6870164 | 0.90 | KDM4E (0.58) | PDE4DMAPTKDM4ERXFP1NPC1 | |
| SCHEMBL7149095 | 0.89 | MAPT (0.54) | ADORA1PDE4DADORA2AMAPTKDM4E | |
| SCHEMBL7146900 | 0.88 | PDE4D (0.50) | PDE4DMAPTKDM4ERXFP1NPC1 | |
| SCHEMBL7045952 | 0.88 | TDP2 (0.52) | TDP2PDE4DMAPTKDM4ERXFP1 | |
| SCHEMBL7145859 | 0.86 | JAK2 (0.54) | TDP2PDE4DMAPTKDM4EGRM5 | |
| SCHEMBL7043536 | 0.85 | MAPT (0.48) | TDP2MAPTKDM4ENPC1RAB9A | |
| SCHEMBL7140763 | 0.84 | MAPT (0.68) | ADORA1PDE4DADORA2AMAPTKDM4E | |
| SCHEMBL7042283 | 0.83 | MAPT (0.56) | ADORA1PDE4DADORA2AMAPTKDM4E | |
| SCHEMBL7039193 | 0.83 | LMNA (0.61) | PDE4DMAPTKDM4ERXFP1NPC1 | |
| SCHEMBL7145323 | 0.83 | PDE4D (0.48) | ADORA1PDE4DADORA2AMAPTKDM4E |
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-6514989-B1 | Has a good affinity to the adenosine receptor and can therefore be used for the treatment or protection of diseases mediated by this receptor | HOFFMANN-LA ROCHE INC. | 2003-02-04 | — | — | US | disclosed |
| US-6514989-B1 | Has a good affinity to the adenosine receptor and can therefore be used for the treatment or protection of diseases mediated by this receptor | HOFFMANN-LA ROCHE INC. | 2003-02-04 | — | — | US | disclosed |
| US-6514989-B1 | Has a good affinity to the adenosine receptor and can therefore be used for the treatment or protection of diseases mediated by this receptor | HOFFMANN-LA ROCHE INC. | 2003-02-04 | — | — | US | disclosed |