Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL8088833 | 1.00 | TSHR (0.45) | TSHRALDH1A1HTR1A | |
| SCHEMBL8973144 | 0.85 | TSHR (0.40) | TSHRALDH1A1 | |
| Hexane SCHEMBL6758220 | 0.84 | CYP1A2 (0.31) | — | |
| Bromoethane SCHEMBL1977824 | 0.75 | — | — | |
| Alcohol SCHEMBL220698 | 0.75 | CES2 (0.32) | ALDH1A1 | |
| Ethylamine SCHEMBL1713257 | 0.75 | — | — | |
| Ethylene SCHEMBL267144 | 0.74 | — | — | |
| SCHEMBL17144160 | 0.74 | — | — | |
| Methylene Chloride SCHEMBL4819617 | 0.72 | — | — | |
| SCHEMBL8744575 | 0.72 | — | — |
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-5912313-A | MOLDINGS, COATINGS, ADHESIVES, MEMBRANES; OXIDATION, HEAT AND CHEMICAL RESISTANCE; DIELECTRICS, INTEGRATED CIRCUITS | THE B. F. GOODRICH COMPANY (US) | 1999-06-15 | — | — | US | disclosed |