Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CDC25A | P30304 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1249304 | 0.88 | CYP1A2 (0.37) | CYP1A2CDC25ALMNABLM | |
| SCHEMBL11294856 | 0.82 | CYP1A2 (0.32) | CYP1A2CDC25A | |
| SCHEMBL119238 | 0.78 | CYP2C9 (0.33) | — | |
| SCHEMBL1199614 | 0.75 | CYP1A2 (0.31) | CYP1A2 | |
| SCHEMBL4251863 | 0.74 | APLNR (0.35) | — | |
| SCHEMBL8762191 | 0.72 | ARG1 (0.34) | — | |
| SCHEMBL7610572 | 0.71 | ARG1 (0.30) | — | |
| SCHEMBL28969694 | 0.71 | KMT2A (0.47) | LMNA | |
| SCHEMBL21998671 | 0.71 | — | — | |
| SCHEMBL3972455 | 0.69 | EPHX1 (0.50) | LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2423291-B1 | PROCESS FOR PRODUCING 1-MENTHYL (3R)-3-HYDROXYBUTANOATE AND COMPOSITION CONTAINING SAME FOR STIMULATING SENSE | TAKASAGO PERFUMERY CO LTD (JP) | 2014-01-01 | — | — | EP | claimed |
| EP-1958627-A2 | Use of certain menthyl-3-oxocarbonic acid esters as physiological cooling agents | Symrise GmbH & Co. KG (DE) | 2008-08-20 | — | — | EP | disclosed |