Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ERN1 | O75460 | 3/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | TDP2 | O95551 | 1/20 | 0.33 |
| ▸ | NSD2 | O96028 | 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 | |
|---|---|---|---|---|
| SCHEMBL30388902 | 0.87 | TRPA1 (0.57) | TRPA1ATMESR1ESR2MAOB | |
| SCHEMBL207038 | 0.87 | TRPA1 (0.57) | TRPA1ATMESR1ESR2MAOB | |
| Phosphine SCHEMBL1067227 | 0.85 | TRPA1 (0.55) | TRPA1ATMESR1ESR2MAOB | |
| Ammonia Solution, Strong SCHEMBL1065150 | 0.85 | TRPA1 (0.55) | TRPA1ATMESR1ESR2MAOB | |
| Hydrochloric Acid SCHEMBL6039932 | 0.82 | TRPA1 (0.52) | TRPA1ATMESR1ESR2MAOB | |
| Acetic Acid SCHEMBL6557428 | 0.81 | TRPA1 (0.46) | TRPA1ATMESR1ESR2MAOB | |
| Dimethylamine SCHEMBL675006 | 0.80 | TRPA1 (0.50) | TRPA1ATMESR1ESR2MAOB | |
| Formic Acid SCHEMBL9009940 | 0.79 | TRPA1 (0.77) | TRPA1ATMESR1ESR2TP53 | |
| Alcohol SCHEMBL28492687 | 0.78 | TRPA1 (0.48) | TRPA1ATMESR1ESR2TP53 | |
| SCHEMBL16852427 | 0.78 | TRPA1 (0.48) | TRPA1ATMESR1ESR2MAOB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0527642-B1 | Process for simultaneously producing lactone and aromatic carboxylic acid | MITSUBISHI GAS CHEMICAL CO (JP) | 1996-11-06 | — | — | EP | disclosed |
| US-5278321-A | Process for simultaneously producing lactone and aromatic carboxylic acid | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1994-01-11 | — | — | US | disclosed |
| EP-0527642-A1 | Process for simultaneously producing lactone and aromatic carboxylic acid | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1993-02-17 | — | — | EP | disclosed |