Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MIF | P14174 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA7 | P43166 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | PFKFB3 | Q16875 | 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 | |
|---|---|---|---|---|
| SCHEMBL30308393 | 0.90 | KDM4E (0.41) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL24189203 | 0.90 | KDM4E (0.41) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL13212 | 0.87 | MAPT (0.39) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL30308402 | 0.87 | LMNA (0.41) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL25883876 | 0.87 | LMNA (0.41) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL24188767 | 0.86 | KDM4E (0.43) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL30308389 | 0.86 | KDM4E (0.43) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL30460538 | 0.84 | ALDH1A1 (0.41) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL7554 | 0.84 | ALDH1A1 (0.41) | ALDH1A1KDM4EGAAMAPTKMT2A | |
| SCHEMBL6985 | 0.82 | POLB (0.37) | ALDH1A1KDM4EGAAMAPTKMT2A |
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-2011058149-A1 | TRICYCLIC PYRAZOL AMINE DERIVATIVES | MERCK SERONO S.A. (CH) | 2011-05-19 | — | — | WO | disclosed |