Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 8/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 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 | |
|---|---|---|---|---|
| SCHEMBL23197679 | 0.82 | TDP1 (0.56) | GSK3BALDH1A1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL17778297 | 0.82 | NQO2 (0.47) | GSK3BALDH1A1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL13680605 | 0.80 | HRH3 (0.50) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL13680706 | 0.78 | NQO2 (0.42) | GSK3BALDH1A1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL20782264 | 0.77 | ESR1 (0.44) | GSK3BALDH1A1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL13680606 | 0.77 | GSK3B (0.38) | GSK3BALDH1A1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL13680607 | 0.77 | HRH3 (0.57) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 | |
| SCHEMBL4444240 | 0.77 | GSK3B (0.57) | GSK3BALDH1A1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL2319851 | 0.76 | TDP1 (0.48) | GSK3BALDH1A1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL22066403 | 0.74 | HPGD (0.56) | ALDH1A1KDM4ESMN1; SMN2HPGDNPC1 |
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 2 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 |