Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.67 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.57 |
| ▸ | MAOB | P27338 | 2/20 | 0.57 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.53 |
| ▸ | AR | P10275 | 1/20 | 0.53 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.53 |
| ▸ | MAP2K3 | P46734 | 1/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10069796 | 0.92 | MAP2K3 (0.59) | KDM4ECYP19A1MAOBMAP2K3LMNA | |
| SCHEMBL6591252 | 0.88 | KDM4E (0.67) | KDM4ECYP19A1MAOBABCB1AR | |
| SCHEMBL6301799 | 0.87 | CYP19A1 (0.53) | KDM4ECYP19A1MAOBABCB1AR | |
| SCHEMBL10069661 | 0.85 | MAP2K3 (0.49) | KDM4ECYP19A1MAOBMAP2K3LMNA | |
| SCHEMBL570789 | 0.85 | ALDH1A1 (0.55) | KDM4ECYP19A1MAOBMAP2K3LMNA | |
| SCHEMBL2820666 | 0.83 | KDM4E (0.56) | KDM4ECYP19A1MAOBMAP2K3ALDH1A1 | |
| SCHEMBL11011694 | 0.81 | CYP19A1 (0.56) | KDM4ECYP19A1MAOBABCB1AR | |
| SCHEMBL7037938 | 0.80 | KDM4E (1.00) | KDM4EMAP2K3GAAALDH1A1CYP3A4 | |
| SCHEMBL6146090 | 0.80 | KDM4E (0.59) | KDM4ECYP19A1MAOBSLC6A2SLC6A4 | |
| SCHEMBL12121778 | 0.80 | KDM4E (0.59) | KDM4ECYP19A1MAOBSLC6A2SLC6A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2600854-A1 | PHENETHYL, PHENETHYLENE, PHENETHYNE AND INDANONE DERIVATES IN COSMETIC FORMULATIONS, ESPECIALLY FOR USE IN SKIN AGEING PROCESSES | Merck Patent GmbH (DE) | 2013-06-12 | — | — | EP | disclosed |
| WO-2012016619-A1 | PHENETHYL, PHENETHYLENE, PHENETHYNE AND INDANONE DERIVATES IN COSMETIC FORMULATIONS, ESPECIALLY FOR USE IN SKIN AGEING PROCESSES | MERCK PATENT GMBH (DE) | 2012-02-09 | — | — | WO | disclosed |
| WO-2012016619-A1 | PHENETHYL, PHENETHYLENE, PHENETHYNE AND INDANONE DERIVATES IN COSMETIC FORMULATIONS, ESPECIALLY FOR USE IN SKIN AGEING PROCESSES | MERCK PATENT GMBH (DE) | 2012-02-09 | — | — | WO | disclosed |