Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4521018 | 0.82 | EPHX1 (0.41) | EPHX1CNR1CNR2CYP2D6CYP2C19 | |
| SCHEMBL4532707 | 0.71 | ANPEP (0.37) | CYP2D6CYP2C19 | |
| Pentane SCHEMBL6411194 | 0.70 | TSHR (0.46) | EPHX1CNR1CNR2CYP2D6CYP2C19 | |
| SCHEMBL1686782 | 0.69 | TSHR (0.40) | EPHX1 | |
| SCHEMBL271458 | 0.66 | — | — | |
| SCHEMBL27628813 | 0.65 | — | — | |
| SCHEMBL723252 | 0.64 | TSHR (0.52) | EPHX1CYP2C19 | |
| SCHEMBL4684668 | 0.64 | TSHR (0.60) | EPHX1CYP2C19 | |
| Hydrochloric Acid SCHEMBL10840766 | 0.64 | TSHR (0.50) | EPHX1CYP2D6CYP2C19 | |
| SCHEMBL4518819 | 0.64 | HRH4 (0.39) | EPHX1CYP2D6CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7507480-B2 | Corrosion-resistant metal surfaces | BROOKHAVEN SCIENCE ASSOCIATES, LLC (US) | 2009-03-24 | — | — | US | disclosed |
| US-20060269760-A1 | Corrosion-resistant metal surfaces | ENERGY, UNITED STATES DEPARTMENT OF | 2006-11-30 | — | — | US | disclosed |