Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 5/20 | 0.42 |
| ▸ | GABBR2 | O75899 | 2/20 | 0.41 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GSR | P00390 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL148756 | 0.85 | TRPA1 (0.48) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL9452584 | 0.85 | HTR2A (0.43) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL9172960 | 0.82 | TRPA1 (0.46) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL6529288 | 0.82 | TRPA1 (0.39) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL9172956 | 0.80 | GABBR2 (0.37) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL28884491 | 0.80 | TRPA1 (0.50) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL28431897 | 0.78 | TRPA1 (0.43) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| Boric Acid SCHEMBL21356833 | 0.78 | TRPA1 (0.43) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL7612634 | 0.78 | TRPA1 (0.43) | TRPA1GABBR2GABBR1CYP2D6CYP1A2 | |
| SCHEMBL5890038 | 0.76 | LMNA (0.48) | TRPA1CYP2D6LMNAHTR2ATAAR1 |
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-6022822-A | Organotin compound and catalyst for transesterification comprising the same | RYOJI NOYORI (JP) | 2000-02-08 | — | — | US | disclosed |