Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 4/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 3/20 | 0.37 |
| ▸ | NOS1 | P29475 | 3/20 | 0.37 |
| ▸ | NOS2 | P35228 | 2/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10834770 | 0.83 | CYP2D6 (0.38) | HRH1CYP2D6NOS3NOS1NOS2 | |
| SCHEMBL21087425 | 0.79 | CYP2D6 (0.40) | HRH1CYP2D6CHRNB2CHRNA4 | |
| SCHEMBL30480965 | 0.77 | NOS1 (0.39) | HRH1CYP2D6NOS3NOS1NOS2 | |
| SCHEMBL295055 | 0.77 | NOS1 (0.39) | HRH1CYP2D6NOS3NOS1NOS2 | |
| SCHEMBL24618582 | 0.75 | HRH4 (0.36) | HRH1CYP2D6CHRNA7NOS1NOS2 | |
| SCHEMBL29792040 | 0.75 | HRH4 (0.36) | HRH1CYP2D6CHRNA7NOS1NOS2 | |
| SCHEMBL5302424 | 0.75 | CYP2D6 (0.35) | HRH1CYP2D6NOS1NOS2 | |
| SCHEMBL511339 | 0.73 | NOS2 (0.43) | HRH1CYP2D6NOS2HRH3KCNH2 | |
| SCHEMBL19180782 | 0.72 | NOS2 (0.44) | HRH1CYP2D6NOS3NOS1NOS2 | |
| SCHEMBL21117404 | 0.72 | CYP2D6 (0.36) | HRH1CYP2D6 |
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-4992268-A | Novel system for monitoring and controlling the papaya fruit fly | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) | 1991-02-12 | — | — | US | disclosed |