Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3887930 | 0.82 | ALDH1A1 (0.50) | GAACA1CA2MMP1MMP2 | |
| SCHEMBL8866790 | 0.81 | SMN1; SMN2 (0.46) | CA1CA2MMP1MMP2MMP9 | |
| SCHEMBL12827982 | 0.79 | PKM (0.52) | GAAAKR1C3CA1CA2MMP1 | |
| SCHEMBL2576334 | 0.79 | GAA (0.54) | GAACA1CA2MMP1MMP2 | |
| SCHEMBL766980 | 0.79 | GAA (0.54) | GAACA1CA2MMP1MMP2 | |
| SCHEMBL9962546 | 0.77 | GAA (0.52) | GAACA1CA2MMP1MMP2 | |
| Ammonia Solution, Strong SCHEMBL5934814 | 0.77 | GAA (0.52) | GAACA1CA2MMP1MMP2 | |
| SCHEMBL11579959 | 0.77 | ALDH1A1 (0.40) | GAAAKR1C3CA1CA2MMP1 | |
| SCHEMBL9755721 | 0.77 | ALDH1A1 (0.50) | GAACA2CA9MEN1KMT2A | |
| SCHEMBL27914208 | 0.76 | GAA (0.56) | GAACA1CA2MMP1MMP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991006533-A1 | NOVEL PROCESS FOR MANUFACTURING COMPOUNDS WITH VALUABLE PHARMACOLOGICAL PROPERTIES AND NEW INTERMEDIATE PRODUCTS FOR THE MANUFACTURE OF THESE COMPOUNDS | BOEHRINGER MANNHEIM GMBH (DE) | 1991-05-16 | — | — | WO | disclosed |