Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
| ▸ | BCHE | P06276 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | MGLL | Q99685 | 1/20 | 0.30 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.30 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13832945 | 0.81 | CES2 (0.30) | ALDH1A1CES2BCHEGAACES1 | |
| SCHEMBL14281159 | 0.79 | HDAC6 (0.32) | ALDH1A1CES2BCHEGAACES1 | |
| SCHEMBL14281160 | 0.78 | FAAH (0.38) | ALDH1A1MGLL | |
| SCHEMBL14281161 | 0.77 | — | — | |
| SCHEMBL15470443 | 0.76 | ALDH1A1 (0.37) | PGRALDH1A1CES2BCHEGAA | |
| SCHEMBL29634622 | 0.76 | ALDH1A1 (0.37) | PGRALDH1A1CES2BCHEGAA | |
| SCHEMBL18493730 | 0.74 | MGLL (0.38) | PGRALDH1A1CES2BCHEGAA | |
| SCHEMBL29368871 | 0.74 | MGLL (0.38) | PGRALDH1A1CES2BCHEGAA | |
| SCHEMBL19072064 | 0.74 | CYP3A4 (0.31) | ALDH1A1MGLL | |
| SCHEMBL13832949 | 0.72 | LIPG (0.41) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10177312-B2 | Compounds for electronic devices | MERCK PATENT GMBH (DE) | 2019-01-08 | — | — | US | disclosed |
| EP-2705550-B1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2017-07-05 | — | — | EP | disclosed |
| US-20140070146-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2014-03-13 | — | — | US | disclosed |
| US-20140070146-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2014-03-13 | — | — | US | disclosed |
| WO-2012149999-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2012-11-08 | — | — | WO | disclosed |