Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 2/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.37 |
| ▸ | LTK | P29376 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | MST1R | Q04912 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8759097 | 0.82 | ALDH1A1 (0.42) | CLK4CYP2A6ALDH1A1HPGDTDP1 | |
| SCHEMBL30332910 | 0.78 | ALOX5 (0.43) | LTA4HALOX5ADORA2AADORA1CDK8 | |
| SCHEMBL3084911 | 0.78 | LTA4H (0.47) | LTA4HALOX5ADORA2AADORA1CDK8 | |
| Hydrogen Sulfide SCHEMBL27738387 | 0.77 | ALOX5 (0.42) | LTA4HALOX5ADORA2AADORA1CDK8 | |
| Hydrogen Sulfide SCHEMBL27605763 | 0.76 | LTA4H (0.46) | LTA4HALOX5ADORA2AADORA1CDK8 | |
| SCHEMBL27510656 | 0.76 | LTA4H (0.53) | LTA4HADORA2AADORA1CYP3A4CYP2C9 | |
| SCHEMBL27891520 | 0.75 | ALOX5 (0.48) | LTA4HALOX5ADORA2AADORA1CDK8 | |
| Hydrogen Sulfide SCHEMBL27800916 | 0.74 | LTA4H (0.44) | LTA4HALOX5ADORA2AADORA1CDK8 | |
| SCHEMBL27684006 | 0.74 | LTA4H (0.52) | LTA4HADORA2AADORA1CYP3A4CYP2C9 | |
| Hydrogen Sulfide SCHEMBL27567732 | 0.74 | LTA4H (0.52) | LTA4HADORA2AADORA1CYP3A4CYP2C9 |
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-2010045013-A1 | PHENYL SUBSTITUTED THIENO [2,3-D] PYRIMIDINES AND THEIR USE AS ADENOSINE A2A RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA NV (BE) | 2010-04-22 | — | — | WO | disclosed |