Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 4/20 | 0.46 |
| ▸ | ALK | Q9UM73 | 5/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14600391 | 0.99 | PDK2 (0.47) | PDK2ALKPTPN1DHODHPTPN11 | |
| SCHEMBL14600359 | 0.96 | PDK2 (0.46) | PDK2ALKPTPN1DHODHPTPN11 | |
| SCHEMBL14600383 | 0.94 | CYP2D6 (0.41) | PDK2PTPN1DHODHCYP1A2CYP2D6 | |
| SCHEMBL14600337 | 0.94 | CYP2D6 (0.43) | PDK2PTPN1DHODHCYP1A2CYP2D6 | |
| SCHEMBL14600331 | 0.93 | CYP2D6 (0.42) | PDK2PTPN1DHODHCYP1A2CYP2D6 | |
| SCHEMBL14600421 | 0.93 | CYP2D6 (0.44) | PDK2ALKCYP1A2CYP2D6CYP19A1 | |
| SCHEMBL14600489 | 0.92 | CYP2D6 (0.43) | PDK2ALKCYP1A2CYP2D6CYP19A1 | |
| SCHEMBL14600345 | 0.91 | CYP2D6 (0.45) | PDK2ALKCYP1A2CYP2D6CYP19A1 | |
| SCHEMBL14600410 | 0.90 | CYP2D6 (0.44) | PDK2ALKCYP1A2CYP2D6CYP19A1 | |
| SCHEMBL10154004 | 0.89 | PDK2 (0.46) | PDK2ALKCYP1A2CYP2D6CYP19A1 |
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-7166240-B2 | Hydrocarbon compounds, materials for organic electroluminescent elements and organic electroluminescent elements | MITSUI CHEMICALS, INC. (JP) | 2007-01-23 | — | — | US | disclosed |