Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.47 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.47 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.45 |
| ▸ | FNTA | P49354 | 1/20 | 0.44 |
| ▸ | FNTB | P49356 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 7/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | RRM1 | P23921 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.40 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.40 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10400683 | 0.92 | EPHX1 (0.53) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL10399529 | 0.92 | EPHX1 (0.53) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL6461481 | 0.88 | USP2 (0.41) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL28077769 | 0.80 | DPP7 (0.55) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL10582035 | 0.79 | ALDH1A1 (0.42) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL9351242 | 0.79 | ALDH1A2 (0.50) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL7404199 | 0.79 | ALDH1A2 (0.50) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL8924516 | 0.79 | — | — | |
| SCHEMBL5001334 | 0.78 | ACHE (0.46) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL10579232 | 0.77 | GNAI3 (0.57) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 |
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-2938641-A1 | MOLECULARLY IMPRINTED POLYMERS AND THEIR USE AS ANTIDANDRUFF AGENTS | L'Oréal (FR) | 2015-11-04 | — | — | EP | disclosed |
| WO-2014102206-A1 | MOLECULARLY IMPRINTED POLYMERS AND THEIR USE AS ANTIDANDRUFF AGENTS | L'OREAL (FR) | 2014-07-03 | — | — | WO | disclosed |
| US-5663365-A | Process for the preparation of pyrazolones | JAPAN HYDRAZINE CO., LTD. (JP) | 1997-09-02 | — | — | US | disclosed |