Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | ERN1 | O75460 | 4/20 | 0.39 |
| ▸ | ATR | Q13535 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13680825 | 0.87 | MAPT (0.41) | ALDH1A1HPGDKMT2AHSD17B10ATR | |
| SCHEMBL13680830 | 0.84 | RARA (0.44) | ALDH1A1KDM4ETP53 | |
| SCHEMBL13680835 | 0.83 | MAP4K4 (0.42) | ERN1MAPK1 | |
| SCHEMBL15349861 | 0.82 | ALDH1A1 (0.44) | ALDH1A1CYP3A4CYP2D6KDM4EHPGD | |
| SCHEMBL13680836 | 0.82 | NPC1 (0.44) | ATRHDAC4 | |
| SCHEMBL13680828 | 0.82 | ALDH1A1 (0.42) | ALDH1A1KDM4EHPGDMEN1KMT2A | |
| SCHEMBL13680842 | 0.81 | RAB9A (0.45) | ALDH1A1KDM4EHPGDKMT2ATSHR | |
| SCHEMBL13680841 | 0.81 | TSHR (0.40) | KDM4EMEN1KMT2ATSHR | |
| SCHEMBL13680831 | 0.81 | PDE10A (0.37) | — | |
| SCHEMBL13680834 | 0.79 | PDE10A (0.39) | ALDH1A1KDM4EHPGDTDP1MEN1 |
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 |