Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 3/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | PLG | P00747 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | CTSG | P08311 | 1/20 | 0.40 |
| ▸ | CMA1 | P23946 | 1/20 | 0.40 |
| ▸ | CTRC | Q99895 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.39 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.39 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 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 | |
|---|---|---|---|---|
| SCHEMBL6427487 | 0.86 | DHPS (0.46) | NR1H2NR1H3ALDH1A1CHRM5KDM4E | |
| SCHEMBL6428548 | 0.85 | NR1H2 (0.56) | NR1H2NR1H3MAPK1MAPTCASP3 | |
| SCHEMBL6428246 | 0.82 | GSK3B (0.39) | NR1H2NR1H3MAPK1MAPTTDP1 | |
| SCHEMBL6431729 | 0.80 | NR1H2 (0.51) | NR1H2NR1H3MAPK1MAPTTDP1 | |
| SCHEMBL6429546 | 0.80 | OPRK1 (0.40) | NR1H2NR1H3CASP3F2PLG | |
| SCHEMBL6429024 | 0.80 | PTGS2 (0.46) | NR1H2NR1H3 | |
| SCHEMBL6427166 | 0.80 | CASP1 (0.47) | NR1H2NR1H3MAPTCASP3ALDH1A1 | |
| SCHEMBL6427122 | 0.77 | NR1H2 (0.47) | NR1H2NR1H3MAPTALDH1A1CHRM5 | |
| SCHEMBL6429398 | 0.76 | NPSR1 (0.41) | NR1H2NR1H3MAPK1MAPTCASP3 | |
| SCHEMBL6427820 | 0.75 | KMT2A (0.47) | NR1H2NR1H3MAPK1MAPTALDH1A1 |
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-2005024755-A2 | MEDICAMENTS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS OR DIABETES | DECIPHERA PHARMACEUTICALS, LLC. (US) | 2005-03-17 | — | — | WO | disclosed |