Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | APAF1 | O14727 | 1/20 | 0.39 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | CDC25A | P30304 | 1/20 | 0.39 |
| ▸ | CDC25B | P30305 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALB | P02768 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | VKORC1 | Q9BQB6 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20544076 | 0.78 | APAF1 (0.37) | MAPTAPAF1CYP2D6SRCLMNA | |
| SCHEMBL23531383 | 0.77 | PDPK1 (0.44) | KDM4EALDH1A1MAPTCYP2D6SRC | |
| SCHEMBL7254921 | 0.76 | NPSR1 (0.50) | KDM4EALDH1A1MAPTMAPK1KMT2A | |
| SCHEMBL8895206 | 0.76 | PDPK1 (0.43) | KDM4EALDH1A1MAPTLMNAKMT2A | |
| SCHEMBL6186896 | 0.75 | PDPK1 (0.47) | KDM4EALDH1A1MAPTCYP2D6LMNA | |
| SCHEMBL20544211 | 0.75 | PDPK1 (0.60) | KDM4EALDH1A1MAPTCDC25BLMNA | |
| SCHEMBL8675122 | 0.74 | CYP2D6 (0.46) | KDM4EALDH1A1MAPTAPAF1MAP2K7 | |
| SCHEMBL1149769 | 0.72 | FFAR1 (0.53) | KDM4EALDH1A1MAPT | |
| SCHEMBL11484603 | 0.72 | FFAR1 (0.53) | KDM4EALDH1A1MAPT | |
| SCHEMBL1149358 | 0.72 | FFAR1 (0.53) | KDM4EALDH1A1MAPT |
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-2828240-B1 | COMPOUNDS FOR A CONTROLLED RELEASE OF ACTIVE PERFUMING MOLECULES | FIRMENICH & CIE (CH) | 2018-10-31 | — | — | EP | claimed |