Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2B6 | P20813 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8186368 | 0.87 | MAPT (0.48) | CYP2B6PKMTSHRL3MBTL1PDE4D | |
| SCHEMBL8182461 | 0.75 | SMN1; SMN2 (0.52) | PKMTSHRL3MBTL1PDE4DTP53 | |
| SCHEMBL2536394 | 0.71 | MAPT (0.35) | L3MBTL1TP53MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL8189626 | 0.67 | TSHR (0.55) | PKMTSHRL3MBTL1PDE4DTP53 | |
| SCHEMBL8191260 | 0.67 | ADORA2B (0.38) | — | |
| SCHEMBL22231439 | 0.66 | NR1H4 (0.59) | TSHRL3MBTL1PDE4DTP53MAPT | |
| SCHEMBL12233446 | 0.64 | ADORA3 (0.35) | — | |
| SCHEMBL29412632 | 0.63 | CYP1A2 (0.63) | PKMTSHRMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL2446906 | 0.63 | CYP1A2 (0.63) | PKMTSHRMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL8761800 | 0.62 | PKM (1.00) | PKMTSHRPDE4DMAPTSMN1; SMN2 |
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-2008077557-A1 | 8-ETHINYLXANTHINE DERIVATIVES AS SELECTIVE A2A RECEPTOR ANTAGONISTS | SCHWARZ PHARMA AG (DE) | 2008-07-03 | — | — | WO | disclosed |