Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | USP1 | O94782 | 2/20 | 0.51 |
| ▸ | WDR48 | Q8TAF3 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL655474 | 0.84 | SIRT5 (0.58) | ALDH1A1KDM4EUSP1WDR48KMT2A | |
| SCHEMBL17011444 | 0.83 | MEN1 (0.46) | ALDH1A1KDM4ECYP1A2CYP2C19MEN1 | |
| SCHEMBL17011498 | 0.82 | MAPT (0.47) | TSHRMEN1KMT2APOLBMAPT | |
| SCHEMBL13550229 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KDM4EUSP1WDR48KMT2A | |
| SCHEMBL13550230 | 0.79 | KDM4E (0.53) | ALDH1A1KDM4EUSP1WDR48KMT2A | |
| SCHEMBL7714240 | 0.79 | AGTR1 (0.48) | ALDH1A1CYP3A4CYP1A2CYP2D6ALOX15 | |
| SCHEMBL29695721 | 0.78 | AURKA (0.70) | ALDH1A1KDM4E | |
| SCHEMBL27870476 | 0.76 | ALDH1A1 (0.49) | ALDH1A1KDM4EUSP1WDR48TSHR | |
| SCHEMBL17011479 | 0.76 | ALDH1A1 (0.40) | ALDH1A1KDM4E | |
| SCHEMBL15809873 | 0.76 | LMNA (0.53) | ALDH1A1KDM4EMEN1KMT2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-20090275070-A1 | Compounds and Methods of Identifying, Synthesizing, Optimizing and Profiling Protein Modulators | HOUSEY GERARD M | 2009-11-05 | — | — | US | disclosed |