Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 1/20 | 0.34 |
| ▸ | S100A4 | P26447 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | CASP3 | P42574 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP4 | P49662 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | CASP9 | P55211 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL8085035 | 0.91 | ALDH1A1 (0.38) | CA9CA1CA2CA7ALDH1A1 | |
| SCHEMBL8077069 | 0.87 | ALDH1A1 (0.35) | CA9CA1CA2CA7ALDH1A1 | |
| SCHEMBL8077241 | 0.87 | ALDH1A1 (0.36) | CA9CA1CA2CA7ALDH1A1 | |
| SCHEMBL8077041 | 0.86 | CA9 (0.42) | CA9CA1CA2CA7TDP1 | |
| SCHEMBL10695563 | 0.84 | CA9 (0.36) | CA9CA1CA2CA7ALDH1A1 | |
| SCHEMBL8090742 | 0.84 | SMN1; SMN2 (0.41) | ALDH1A1CYP3A4TDP1MAPTMEN1 | |
| SCHEMBL7268307 | 0.82 | ALDH1A1 (0.39) | CA9CA1CA2CA7ALDH1A1 | |
| SCHEMBL7267833 | 0.80 | PDE4A (0.42) | MAPTCASP3MALT1LMNA | |
| SCHEMBL7266970 | 0.80 | ABCC9 (0.41) | MEN1KMT2AMALT1 | |
| SCHEMBL10697020 | 0.79 | ALDH1A1 (0.36) | CA9CA1CA2CA7ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0273262-A2 | Chroman derivatives | MERCK PATENT GmbH (DE) | 1988-07-06 | — | — | EP | disclosed |