Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL1769086 | 0.82 | CYP3A4 (0.47) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL109280 | 0.80 | CYP3A4 (0.62) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL3329615 | 0.79 | CYP3A4 (0.44) | CYP3A4GABRA1GABRB2 | |
| SCHEMBL462306 | 0.79 | CYP3A4 (0.52) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL11871641 | 0.76 | CYP3A4 (0.54) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL17472548 | 0.76 | CYP3A4 (0.48) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL28570936 | 0.74 | CYP3A4 (0.56) | CYP3A4GABRA1GABRB2TRPA1 | |
| SCHEMBL9630315 | 0.74 | CYP3A4 (0.40) | CYP3A4GABRA1GABRB2 | |
| SCHEMBL1035105 | 0.74 | CYP3A4 (0.40) | CYP3A4GABRA1GABRB2 | |
| SCHEMBL17007517 | 0.72 | CYP3A4 (0.54) | CYP3A4GABRA1GABRB2TRPA1 |
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-3939124-A | Fire-retardant polyurethane resins prepared from side-chain halogenated aromatic polyisocyanates | TENNECO CHEMICALS, INC. (US) | 1976-02-17 | — | — | US | claimed |
| US-3939124-A | Fire-retardant polyurethane resins prepared from side-chain halogenated aromatic polyisocyanates | TENNECO CHEMICALS, INC. (US) | 1976-02-17 | — | — | US | disclosed |