Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.46 |
| ▸ | FLT3 | P36888 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8189626 | 0.83 | TSHR (0.55) | SMN1; SMN2PKMTSHRHSD17B10PDE4D | |
| SCHEMBL12233427 | 0.81 | KDM4E (0.38) | SMN1; SMN2TSHRHSD17B10KMT2AMEN1 | |
| SCHEMBL8194740 | 0.75 | CYP2B6 (0.43) | SMN1; SMN2PKMTSHRHSD17B10PDE4D | |
| SCHEMBL8761800 | 0.67 | PKM (1.00) | SMN1; SMN2PKMTSHRPDE4DMAOA | |
| SCHEMBL26307991 | 0.67 | PKM (0.83) | SMN1; SMN2PKMTSHRPDE4DMAOA | |
| SCHEMBL4183893 | 0.66 | KMT2A (0.65) | SMN1; SMN2PKMKMT2AMEN1ALDH1A1 | |
| SCHEMBL6500203 | 0.65 | CYP1A2 (0.63) | SMN1; SMN2PKMTSHRPDE4DKMT2A | |
| SCHEMBL29412632 | 0.65 | CYP1A2 (0.63) | SMN1; SMN2PKMTSHRKMT2AMEN1 | |
| SCHEMBL2446906 | 0.65 | CYP1A2 (0.63) | SMN1; SMN2PKMTSHRKMT2AMEN1 | |
| SCHEMBL28961053 | 0.65 | CYP1A2 (0.63) | SMN1; SMN2PKMTSHRPDE4DFLT3 |
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 |