Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GHSR | Q92847 | 3/20 | 0.47 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20765512 | 1.00 | GHSR (0.47) | GHSRPTGDR2ALDH1A1KDM4EHTT | |
| SCHEMBL20782581 | 0.86 | ACHE (0.41) | ALDH1A1KDM4EHTTUSP2ROCK2 | |
| SCHEMBL20765484 | 0.82 | CCR1 (0.44) | GHSRPTGDR2ALDH1A1KDM4EHTT | |
| SCHEMBL20765488 | 0.82 | CCR1 (0.44) | GHSRPTGDR2ALDH1A1KDM4EHTT | |
| SCHEMBL20765527 | 0.80 | MAPK14 (0.44) | GHSRDRD2MEN1KMT2ADRD3 | |
| SCHEMBL20765524 | 0.80 | MAPK14 (0.44) | GHSRDRD2MEN1KMT2ADRD3 | |
| SCHEMBL20765555 | 0.72 | ALDH1A1 (0.66) | ALDH1A1KDM4EHTTSMN1; SMN2USP2 | |
| SCHEMBL20765826 | 0.71 | BCHE (0.41) | ALDH1A1KDM4EROCK2POLB | |
| SCHEMBL20765824 | 0.71 | BCHE (0.41) | ALDH1A1KDM4EROCK2POLB | |
| SCHEMBL10007463 | 0.71 | PKM (0.61) | ALDH1A1 |
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-2019038683-A1 | COMPOUNDS TARGETING TANDEM BRCT DOMAINS OF BRCA1, COMPOSITIONS AND METHODS THEREOF | INSTITUTE FOR STEM CELL BIOLOGY AND REGENERATIVE MEDICINE (IN) | 2019-02-28 | — | — | WO | claimed |