Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 13/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13499189 | 0.79 | HRH3 (0.55) | HRH3MEN1CYP2D6CYP2C19KMT2A | |
| SCHEMBL7549907 | 0.78 | HRH3 (0.47) | HRH3KCNH2CYP2C9LTA4HESR1 | |
| SCHEMBL8542490 | 0.75 | MEN1 (0.53) | CYP2C9MEN1CYP2D6CYP2C19KMT2A | |
| SCHEMBL4599631 | 0.75 | MEN1 (0.53) | CYP2C9MEN1CYP2D6CYP2C19KMT2A | |
| SCHEMBL7554518 | 0.75 | HRH3 (0.53) | HRH3LTA4HMEN1KMT2A | |
| SCHEMBL13499191 | 0.75 | HRH3 (0.56) | HRH3MEN1CYP2D6CYP2C19KMT2A | |
| SCHEMBL21427 | 0.74 | NQO1 (0.47) | LTA4HMEN1KMT2ACHRNB2CHRNA7 | |
| SCHEMBL3348073 | 0.73 | MEN1 (0.54) | CYP2C9MEN1CYP2D6CYP2C19KMT2A | |
| SCHEMBL30748884 | 0.71 | LTA4H (0.57) | KCNH2CYP2C9LTA4HMEN1CYP2D6 | |
| SCHEMBL8385088 | 0.70 | LTA4H (0.44) | CYP2C9LTA4HMEN1CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010049678-A2 | TREATMENT OF ENERGY UTILIZATION DISEASES | SUMMIT CORPORATION PLC (GB) | 2010-05-06 | — | — | WO | disclosed |