Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA3 | P07451 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16226897 | 0.87 | CYP3A4 (0.56) | CYP3A4LMNAMAPK1USP2SMN1; SMN2 | |
| SCHEMBL11321057 | 0.85 | CYP3A4 (0.54) | CYP3A4LMNAMAPK1USP2SMN1; SMN2 | |
| SCHEMBL23190743 | 0.78 | CYP3A4 (0.55) | CYP3A4LMNAMAPK1USP2SMN1; SMN2 | |
| SCHEMBL684391 | 0.78 | CYP3A4 (0.64) | CYP3A4LMNAMAPK1USP2SMN1; SMN2 | |
| SCHEMBL27655178 | 0.78 | CYP3A4 (0.59) | CYP3A4LMNAMAPK1USP2SMN1; SMN2 | |
| SCHEMBL16226426 | 0.77 | CYP3A4 (0.50) | CYP3A4LMNAMAPK1USP2SMN1; SMN2 | |
| SCHEMBL16226383 | 0.76 | CYP3A4 (0.49) | CYP3A4LMNAMAPK1USP2SMN1; SMN2 | |
| SCHEMBL9752762 | 0.75 | CYP3A4 (0.78) | CYP3A4LMNAMAPK1USP2SMN1; SMN2 | |
| SCHEMBL9617423 | 0.75 | IDO1 (0.48) | CYP3A4LMNAMAPK1USP2SMN1; SMN2 | |
| Isotorachrysone SCHEMBL16226209 | 0.75 | CYP3A4 (0.47) | CYP3A4LMNAMAPK1USP2SMN1; 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-2022122921-A1 | PROCESS FOR THE BIOTECHNOLOGICAL PRODUCTION OF 2-PHENYLETHANOLS FROM PLANT SOURCES | TECHNISCHE UNIVERSITÄT BERGAKADEMIE FREIBERG (DE) | 2022-06-16 | — | — | WO | disclosed |