Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7546837 | 0.98 | CHRNB4 (0.32) | CHRNB4CHRNA3 | |
| SCHEMBL7546849 | 0.98 | CHRNB4 (0.32) | CHRNB4CHRNA3 | |
| SCHEMBL7546844 | 0.98 | CHRNB4 (0.32) | CHRNB4CHRNA3 | |
| SCHEMBL1006893 | 0.92 | CHRNB4 (0.35) | CHRNB4CHRNA3PTGS2TDP1TSHR | |
| SCHEMBL1006892 | 0.92 | CHRNB4 (0.35) | CHRNB4CHRNA3PTGS2TDP1TSHR | |
| SCHEMBL30315864 | 0.87 | CHRNB4 (0.32) | CHRNB4CHRNA3 | |
| SCHEMBL11594509 | 0.81 | — | — | |
| SCHEMBL11594512 | 0.81 | — | — | |
| Biphenyl SCHEMBL6138056 | 0.79 | ALDH1A1 (0.50) | TDP1 | |
| Biphenyl SCHEMBL27668291 | 0.79 | ALDH1A1 (0.50) | TDP1 |
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-5128296-A | Using activated ruthenium catalyst complexes | PHILLIPS PETROLEUM COMPANY (US) | 1992-07-07 | — | — | US | disclosed |