Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | MPI | P34949 | 1/20 | 0.33 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.32 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL15042299 | 0.95 | BACE1 (0.34) | KDM4EALDH1A1MAPTHPGDMEN1 | |
| SCHEMBL12011512 | 0.95 | BACE1 (0.34) | KDM4EALDH1A1MAPTHPGDMEN1 | |
| SCHEMBL17263977 | 0.92 | ALDH1A1 (0.36) | KDM4EALDH1A1MAPTHPGDMEN1 | |
| SCHEMBL15042343 | 0.91 | IMPDH2 (0.33) | KDM4EALDH1A1MAPTHPGDMEN1 | |
| SCHEMBL12576984 | 0.88 | IMPDH2 (0.34) | KDM4EALDH1A1MAPTHPGDMEN1 | |
| SCHEMBL12700365 | 0.87 | CYP1A2 (0.35) | KDM4EALDH1A1MAPTHPGDMEN1 | |
| SCHEMBL2326965 | 0.87 | ALDH1A1 (0.39) | KDM4EALDH1A1MAPTHPGDMEN1 | |
| SCHEMBL23849282 | 0.85 | PTGDR2 (0.35) | HPGDKMT2AMAPK1PTGDR2CYP1A2 | |
| SCHEMBL12576974 | 0.85 | ALDH1A1 (0.35) | KDM4EALDH1A1MAPTHPGDMEN1 | |
| SCHEMBL15042411 | 0.85 | ALDH1A1 (0.38) | KDM4EALDH1A1MAPTMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-20130193382-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2013-08-01 | — | — | US | disclosed |
| US-20130193382-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2013-08-01 | — | — | US | disclosed |
| WO-2012048780-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2012-04-19 | — | — | WO | disclosed |