Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.59 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | HNF4A | P41235 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.42 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.41 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21530613 | 0.86 | TRPA1 (0.63) | TRPA1MMP1MMP2MMP9BCHE | |
| SCHEMBL30477514 | 0.86 | TRPA1 (0.63) | TRPA1MMP1MMP2MMP9BCHE | |
| SCHEMBL1647970 | 0.86 | TRPA1 (0.63) | TRPA1MMP1MMP2MMP9BCHE | |
| SCHEMBL27726579 | 0.85 | TRPA1 (0.61) | TRPA1CYP2C19NFE2L2MAOB | |
| SCHEMBL1415253 | 0.83 | SIRT2 (0.51) | TRPA1BCHEMAPTCYP2C19NFE2L2 | |
| SCHEMBL26744668 | 0.83 | TRPA1 (0.59) | TRPA1MMP1MMP2MMP9BCHE | |
| SCHEMBL29781349 | 0.83 | TRPA1 (0.59) | TRPA1CYP2C19NFE2L2MAOB | |
| SCHEMBL9294233 | 0.80 | CA12 (0.61) | TRPA1MMP1MMP2MMP9MAPT | |
| SCHEMBL9294229 | 0.80 | CA12 (0.61) | TRPA1MMP1MMP2MMP9MAPT | |
| SCHEMBL29957501 | 0.77 | ERN1 (0.55) | MAPTCA1CA2NFKB1CA12 |
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-6224848-B1 | Pharmaceuticals providing diagnosis and selective tissue necrosis using Mossbauer absorber atom | MILLS RANDELL L (US) | 2001-05-01 | — | — | US | claimed |
| US-3946734-A | APPARATUS FOR CONTROLLING THE RELEASE OF A DRUG | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF STATE (US) | 1976-03-30 | — | — | US | disclosed |