Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 7/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | MAP2 | P11137 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 3/20 | 0.34 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10153398 | 0.99 | ACHE (0.40) | PDK2ACHEPTGS2MAP2PGR | |
| SCHEMBL10153417 | 0.97 | PDK2 (0.41) | PDK2ACHEPTGS2MAP2PGR | |
| SCHEMBL10153501 | 0.97 | ACHE (0.39) | PDK2ACHEPTGS2MAP2PGR | |
| SCHEMBL10153585 | 0.97 | PDK2 (0.43) | PDK2ACHEPTGS2PGRSQOR | |
| SCHEMBL10153498 | 0.96 | PDK2 (0.39) | PDK2ACHEPTGS2MAP2SQOR | |
| SCHEMBL14600413 | 0.93 | PDK2 (0.46) | PDK2ACHEPTGS2PGR | |
| SCHEMBL10153619 | 0.91 | PDK2 (0.44) | PDK2ACHEPTGS2PGR | |
| SCHEMBL10153486 | 0.91 | PDK2 (0.43) | PDK2ACHEPTGS2PGRSQOR | |
| SCHEMBL10153582 | 0.90 | PDK2 (0.51) | PDK2PGRTAAR1 | |
| SCHEMBL10153224 | 0.90 | PDK2 (0.46) | PDK2ACHEPTGS2PGRSQOR |
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-1221434-B1 | HYDROCARBON COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT | MITSUI CHEMICALS INC (JP) | 2012-06-27 | — | — | EP | disclosed |
| US-7166240-B2 | Hydrocarbon compounds, materials for organic electroluminescent elements and organic electroluminescent elements | MITSUI CHEMICALS, INC. (JP) | 2007-01-23 | — | — | US | disclosed |
| US-7166240-B2 | Hydrocarbon compounds, materials for organic electroluminescent elements and organic electroluminescent elements | MITSUI CHEMICALS, INC. (JP) | 2007-01-23 | — | — | US | disclosed |