Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.44 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.39 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
| ▸ | GHSR | Q92847 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20765484 | 1.00 | CCR1 (0.44) | CCR1BCHEACHEPLA2G2AMAPK14 | |
| SCHEMBL20765824 | 0.88 | BCHE (0.41) | BCHEACHECHEK2KDM4EALDH1A1 | |
| SCHEMBL20765826 | 0.88 | BCHE (0.41) | BCHEACHECHEK2KDM4EALDH1A1 | |
| SCHEMBL20765527 | 0.83 | MAPK14 (0.44) | BCHEACHEPLA2G2AMAPK14DRD2 | |
| SCHEMBL20765524 | 0.83 | MAPK14 (0.44) | BCHEACHEPLA2G2AMAPK14DRD2 | |
| SCHEMBL20765509 | 0.82 | GHSR (0.47) | MAPK14HTTPTGDR2KDM4EALDH1A1 | |
| SCHEMBL20765512 | 0.82 | GHSR (0.47) | MAPK14HTTPTGDR2KDM4EALDH1A1 | |
| SCHEMBL17954168 | 0.72 | ALDH1A1 (0.51) | MAPK14L3MBTL1KDM4EALDH1A1POLB | |
| SCHEMBL20765458 | 0.72 | BCHE (0.42) | BCHEACHEMAPK14ALDH1A1POLB | |
| SCHEMBL20765490 | 0.71 | MAPK14 (0.54) | BCHEACHEMAPK14L3MBTL1CHEK2 |
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 |