Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | KDM1A | O60341 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | SAT1 | P21673 | 3/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PAOX | Q6QHF9 | 2/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4527099 | 0.82 | CYP2C19 (0.52) | CYP2C19CYP1A2KDM1AMEN1GLA | |
| SCHEMBL4533802 | 0.82 | CYP2C19 (0.52) | CYP2C19CYP1A2KDM1AMEN1GLA | |
| SCHEMBL4519318 | 0.80 | CYP2C19 (0.50) | CYP2C19CYP1A2KDM1AMEN1GLA | |
| SCHEMBL4515293 | 0.77 | ALDH1A1 (0.54) | TSHRALDH1A1PAOXEPHX1 | |
| SCHEMBL4531011 | 0.77 | ALDH1A1 (0.54) | TSHRALDH1A1PAOXEPHX1 | |
| SCHEMBL4523098 | 0.77 | ALDH1A1 (0.54) | TSHRALDH1A1PAOXEPHX1 | |
| SCHEMBL4529808 | 0.76 | KDM1A (0.35) | CYP2C19CYP1A2KDM1AMEN1KMT2A | |
| SCHEMBL7089751 | 0.75 | CYP2C19 (0.80) | CYP2C19CYP1A2KDM1AMEN1GLA | |
| SCHEMBL13893419 | 0.75 | CYP2C19 (0.80) | CYP2C19CYP1A2KDM1AMEN1GLA | |
| SCHEMBL19620508 | 0.75 | CYP2C19 (0.80) | CYP2C19CYP1A2KDM1AMEN1GLA |
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 |