Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.61 |
| ▸ | NQO2 | P16083 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 6/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.47 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.47 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL13680465 | 0.85 | GSK3B (0.61) | GSK3BNQO2MAPTTP53SMN1; SMN2 | |
| SCHEMBL13680503 | 0.83 | GSK3B (0.62) | GSK3BNQO2TP53SMN1; SMN2ALDH1A1 | |
| SCHEMBL23197679 | 0.81 | TDP1 (0.56) | GSK3BNQO2MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL13680696 | 0.81 | GSK3B (0.43) | GSK3BNQO2MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL13680504 | 0.80 | PLK1 (0.50) | GSK3BNQO2MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL5655892 | 0.80 | GSK3B (0.64) | GSK3BMAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL13680494 | 0.80 | ALDH1A1 (0.46) | GSK3BNQO2MAPTSMN1; SMN2HSD17B1 | |
| SCHEMBL27312483 | 0.79 | GSK3B (0.52) | GSK3BMAPTTP53SMN1; SMN2HSD17B1 | |
| SCHEMBL31331819 | 0.79 | MAPT (0.50) | GSK3BNQO2MAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL17742690 | 0.79 | GSK3B (0.52) | GSK3BNQO2MAPTTP53SMN1; SMN2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |
| EP-1905762-A1 | PYRAZOLONE DERIVATIVE | Genecare Research Institute Co., Ltd (JP) | 2008-04-02 | — | — | EP | disclosed |
| EP-1900728-A1 | PHARMACEUTICAL COMPOSITION COMPRISING PYRAZOLONE DERIVATIVE | Genecare Research Institute Co., Ltd (JP) | 2008-03-19 | — | — | EP | disclosed |