Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPA3 | P15088 | 3/20 | 0.60 |
| ▸ | CPA1 | P15085 | 2/20 | 0.60 |
| ▸ | CPB1 | P15086 | 1/20 | 0.60 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | MIF | P14174 | 1/20 | 0.50 |
| ▸ | ALPI | P09923 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | XIAP | P98170 | 1/20 | 0.48 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.48 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.46 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.46 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1287678 | 0.79 | EPHX1 (0.55) | CYP1A2ALPIPKMPTGS1XIAP | |
| SCHEMBL5081346 | 0.78 | CPA3 (0.64) | CPA3CPA1CPB1CPB2CYP1A2 | |
| SCHEMBL5081348 | 0.78 | CPA3 (0.64) | CPA3CPA1CPB1CPB2CYP1A2 | |
| SCHEMBL6176552 | 0.78 | CPA3 (0.64) | CPA3CPA1CPB1CPB2CYP1A2 | |
| SCHEMBL11460484 | 0.78 | CPA3 (0.64) | CPA3CPA1CPB1CPB2CYP1A2 | |
| SCHEMBL10535065 | 0.77 | TRPA1 (0.65) | CPA3CPA1CPB1CPB2CYP1A2 | |
| SCHEMBL4223754 | 0.77 | CPA3 (0.62) | CPA3CPA1CPB1CPB2CYP1A2 | |
| SCHEMBL4315598 | 0.77 | CPA1 (0.62) | CPA3CPA1CPB1CPB2CYP1A2 | |
| SCHEMBL4223751 | 0.77 | CPA3 (0.62) | CPA3CPA1CPB1CPB2CYP1A2 | |
| SCHEMBL6138407 | 0.77 | TRPA1 (0.65) | CPA3CPA1CPB1CPB2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2838927-A2 | SULFONIUM COMPOUNDS, THEIR PREPARATION AND USE | BASF SE (DE) | 2015-02-25 | — | — | EP | disclosed |
| WO-2013156509-A2 | SULFONIUM COMPOUNDS, THEIR PREPARATION AND USE | BASF SE (DE) | 2013-10-24 | — | — | WO | disclosed |