Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.34 |
| ▸ | PRKACA | P17612 | 3/20 | 0.34 |
| ▸ | PRKACG | P22612 | 3/20 | 0.34 |
| ▸ | PRKACB | P22694 | 3/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.34 |
| ▸ | WDR5 | P61964 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | PLG | P00747 | 1/20 | 0.34 |
| ▸ | PLAU | P00749 | 1/20 | 0.34 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.34 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | FASN | P49327 | 1/20 | 0.33 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6729868 | 0.79 | FASN (0.36) | SLC6A2SLC6A4SLC6A3FASN | |
| SCHEMBL13604748 | 0.78 | OPRM1 (0.51) | F2F10PLGPLAUST14 | |
| SCHEMBL3692393 | 0.78 | TP53 (0.43) | MAP4K4MAP3K11 | |
| SCHEMBL3698984 | 0.78 | OPRM1 (0.48) | SLC6A2SLC6A4SLC6A3FASN | |
| SCHEMBL3693392 | 0.76 | OPRM1 (0.43) | WDR5F2F10PLGPLAU | |
| SCHEMBL3695933 | 0.76 | CACNA2D1 (0.38) | AOC3SLC6A2SLC6A4SLC6A3PRKACA | |
| SCHEMBL27711121 | 0.75 | DYRK1A (0.42) | CDK8MAP4K4MAP3K11 | |
| SCHEMBL27731712 | 0.69 | WDR5 (0.47) | WDR5 | |
| SCHEMBL3697284 | 0.68 | MAPK14 (0.55) | PRKACAPRKACGPRKACBCDK2MAP3K11 | |
| SCHEMBL3705209 | 0.68 | MAP4K4 (0.52) | PRKACAPRKACGPRKACBCDK2MAP4K4 |
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-1851199-B1 | SUBSTITUTED BIS ARYL AND HETEROARYL COMPOUNDS AS SELECTIVE 5HT2A ANTAGONISTS | AVENTIS PHARMA INC (US) | 2012-05-16 | — | — | EP | disclosed |