Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.53 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13359142 | 0.90 | MAPT (0.48) | ALDH1A1KDM4EMAPTHPGDRECQL | |
| SCHEMBL13797975 | 0.82 | MAPK14 (0.55) | ALDH1A1KDM4EMAPTHPGDRECQL | |
| SCHEMBL13359167 | 0.81 | MAPK14 (0.54) | ALDH1A1KDM4EMAPTHPGDRECQL | |
| SCHEMBL13359147 | 0.79 | MAPK14 (0.64) | ALDH1A1KDM4EMAPTHPGDRECQL | |
| SCHEMBL13359226 | 0.78 | MAPK1 (0.55) | ALDH1A1KDM4EMAPTHPGDRECQL | |
| SCHEMBL13797973 | 0.77 | LYN (0.58) | ALDH1A1KDM4EMAPTHPGDRECQL | |
| SCHEMBL13359289 | 0.75 | LYN (0.60) | ALDH1A1KDM4EMAPTHPGDRECQL | |
| SCHEMBL13797974 | 0.74 | LYN (0.74) | ALDH1A1KDM4EMAPTHPGDRECQL | |
| SCHEMBL13798012 | 0.73 | LYN (0.60) | MAPK14LYNMAPK9 | |
| SCHEMBL13359237 | 0.73 | LYN (0.55) | ALDH1A1KDM4EMAPTHPGDRECQL |
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 |
|---|---|---|---|---|---|---|---|
| US-7550461-B2 | Benzofuran and benzothiophene compounds useful in treating cytokine mediated diseases | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2009-06-23 | — | — | US | disclosed |