Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL313576 | 0.87 | — | — | |
| SCHEMBL18173924 | 0.87 | — | — | |
| SCHEMBL7875676 | 0.82 | — | — | |
| Fluoride SCHEMBL27451870 | 0.82 | — | — | |
| Tetrafluoroethylene SCHEMBL10747745 | 0.78 | TSHR (0.36) | TSHRCASP1 | |
| Ethylene SCHEMBL26633922 | 0.75 | — | — | |
| Carbon Tetrachloride SCHEMBL16469582 | 0.70 | TSHR (0.73) | TSHRALDH1A1LMNACYP2E1CASP1 | |
| SCHEMBL30757569 | 0.69 | — | — | |
| SCHEMBL19459600 | 0.68 | — | — | |
| SCHEMBL23495385 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-107400040-B | Preparation method of 2, 2-difluoro-1, 3-propanediol | 山东飞源新材料有限公司 | 2020-12-25 | — | — | CN | disclosed |