Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
| ▸ | VDR | P11473 | 1/20 | 0.38 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27509299 | 0.81 | GAA (0.50) | GAACA1CA2CA12CA9 | |
| SCHEMBL25277145 | 0.81 | GAA (0.42) | GAACA1CA2CA12CA9 | |
| SCHEMBL8309170 | 0.81 | GAA (0.42) | GAACA1CA2CA12CA9 | |
| SCHEMBL1393862 | 0.81 | GAA (0.42) | GAACA1CA2CA12CA9 | |
| SCHEMBL7463761 | 0.79 | ALDH1A1 (0.41) | GAACA1CA2CA12CA9 | |
| SCHEMBL10733069 | 0.79 | CA2 (0.43) | CA1CA2CA12CA9CA3 | |
| SCHEMBL8368948 | 0.77 | VDR (0.40) | GAACA1CA2CA12CA9 | |
| SCHEMBL2342945 | 0.75 | GAA (0.52) | GAACA1CA2CA12CA9 | |
| SCHEMBL5557903 | 0.75 | GAA (0.52) | GAACA1CA2CA12CA9 | |
| SCHEMBL890642 | 0.74 | GAA (0.50) | GAACA1CA2CA12CA9 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1169309-A4 | PROPYNYL URACILS | LONZA AG (US) | 2002-06-05 | — | — | EP | claimed |
| EP-1169309-A1 | PROPYNYL URACILS | LONZA INC. (US) | 2002-01-09 | — | — | EP | claimed |
| WO-2000061565-A1 | PROPYNYL URACILS | LONZA INC. (US) | 2000-10-19 | — | — | WO | claimed |
| EP-1169309-A4 | PROPYNYL URACILS | LONZA AG (US) | 2002-06-05 | — | — | EP | disclosed |
| US-6344460-B1 | BACTERICIDES, FUNGICIDES, AND PRESERVATIVES | LONZA INC. | 2002-02-05 | — | — | US | disclosed |
| EP-1169309-A1 | PROPYNYL URACILS | LONZA INC. (US) | 2002-01-09 | — | — | EP | disclosed |
| WO-2000061565-A1 | PROPYNYL URACILS | LONZA INC. (US) | 2000-10-19 | — | — | WO | disclosed |
| US-5354862-A | Preparation and the use of halopropargylated cyclic quaternary ammonium compounds as antimicrobial agents | ROHM AND HAAS COMPANY (US) | 1994-10-11 | — | — | US | disclosed |
| US-5266567-A | Bactericides, fungicides, algicides | ROHM AND HAAS COMPANY (US) | 1993-11-30 | — | — | US | disclosed |
| EP-0539114-A2 | Halopropargylated cyclic quaternary ammonium compound as antimicrobial agents | ROHM AND HAAS COMPANY (US) | 1993-04-28 | — | — | EP | disclosed |
| US-4647572-A | Iodoallyl and iodopropargyl substituted tetrazoles and anti-microbial compositions thereof | MEIJI SEIKA KAISHA, LTD. (JP) | 1987-03-03 | — | — | US | disclosed |
| EP-0107859-A1 | Tetrazole compounds, process for preparing the same and antibacterial and antifungal compositions containing the same as active ingredient | MEIJI SEIKA KAISHA LTD. (JP) | 1984-05-09 | — | — | EP | disclosed |