Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL9765921 | 0.72 | ALDH1A1 (0.59) | ADORA2AADORA2BALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL8937183 | 0.72 | KDM4E (0.43) | ALDH1A1KDM4EHPGDTSHRMEN1 | |
| SCHEMBL23797830 | 0.71 | HTT (0.42) | ADORA2AADORA2BALDH1A1KDM4EHSD17B10 | |
| SCHEMBL4623478 | 0.71 | KDM4E (0.38) | ALDH1A1SMN1; SMN2KDM4EHPGDMEN1 | |
| SCHEMBL9765915 | 0.70 | ALDH1A1 (0.52) | ADORA2BALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL7624092 | 0.69 | KDM4E (0.42) | ADORA2AADORA2BALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL3110932 | 0.68 | PDE1A (0.53) | HPGDMEN1KMT2A | |
| SCHEMBL5647 | 0.67 | ADORA2A (0.43) | ADORA2AADORA2BALDH1A1KDM4EMAPK1 | |
| SCHEMBL1804901 | 0.67 | KDM4E (0.41) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL4621732 | 0.66 | ADORA2A (0.43) | ADORA2AADORA2BALDH1A1KDM4EMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0383868-A4 | 1,3-UNSYMMETRICAL STRAIGHT CHAIN ALKYL-SUBSTITUTED 8-PHENYLXANTHINES | — | 1991-12-04 | — | — | EP | disclosed |
| EP-0383868-A1 | 1,3-UNSYMMETRICAL STRAIGHT CHAIN ALKYL-SUBSTITUTED 8-PHENYLXANTHINES | MARION LABORATORIES, INC. (US) | 1990-08-29 | — | — | EP | disclosed |
| WO-1990000056-A1 | 1,3-UNSYMMETRICAL STRAIGHT CHAIN ALKYL-SUBSTITUTED 8-PHENYLXANTHINES | MARION LABORATORIES, INC. (US) | 1990-01-11 | — | — | WO | disclosed |