Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.48 |
| ▸ | IKBKB | O14920 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | RORB | Q92753 | 2/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.43 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 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 | |
|---|---|---|---|---|
| SCHEMBL984768 | 0.77 | KDM4E (0.63) | RORBRORCXDHCYP1A2CYP3A4 | |
| SCHEMBL13616808 | 0.76 | ALDH1A1 (0.46) | ADORA2AADORA1XDHPIK3CDPIK3CA | |
| SCHEMBL12631776 | 0.76 | HSD17B1 (0.49) | ADORA1CYP3A4CYP2C9PIK3CDPIK3CA | |
| SCHEMBL27803417 | 0.76 | RORB (0.47) | RORBRORCXDHCYP2C19ALDH1A1 | |
| SCHEMBL13616783 | 0.74 | KDM4E (0.53) | ADORA2AADORA1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27803418 | 0.74 | ALDH1A1 (0.46) | RORBRORCALDH1A1 | |
| SCHEMBL982262 | 0.73 | RORB (0.50) | MAPK1RORBRORCCYP1A2CYP3A4 | |
| SCHEMBL28182113 | 0.73 | TGFBR1 (0.51) | ADORA2AADORA1RORBRORCSCN2A | |
| SCHEMBL27732975 | 0.72 | LTA4H (0.51) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL29678302 | 0.71 | TSHR (0.58) | TSHRMAPK1SCN2AALDH1A1IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2119716-A1 | AZA-BRIDGED-RING COMPOUND | Astellas Pharma Inc. (JP) | 2009-11-18 | — | — | EP | disclosed |