Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | CTSD | P07339 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALPL | P05186 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8490985 | 0.77 | HPD (0.52) | ALDH1A1MAPTLMNAKDM4EMEN1 | |
| SCHEMBL8490983 | 0.77 | HPD (0.52) | ALDH1A1MAPTLMNAKDM4EMEN1 | |
| SCHEMBL7761933 | 0.77 | ALDH1A1 (0.58) | ALDH1A1CTSDMAPTLMNAKDM4E | |
| SCHEMBL4464211 | 0.77 | ALDH1A1 (0.55) | ALDH1A1CTSDMAPTLMNAHSP90AA1 | |
| SCHEMBL29744419 | 0.77 | ALDH1A1 (0.55) | ALDH1A1CTSDMAPTLMNAHSP90AA1 | |
| SCHEMBL4464214 | 0.77 | ALDH1A1 (0.55) | ALDH1A1CTSDMAPTLMNAHSP90AA1 | |
| SCHEMBL1810685 | 0.77 | ALDH1A1 (0.43) | ALDH1A1MAPTLMNATSHRNPSR1 | |
| SCHEMBL1697511 | 0.75 | ALDH1A1 (0.59) | ALDH1A1CTSDMAPTLMNAHSP90AA1 | |
| SCHEMBL28408395 | 0.75 | ALDH1A1 (0.63) | ALDH1A1CTSDMAPTKDM4EALPL | |
| SCHEMBL334763 | 0.75 | ALDH1A1 (0.63) | ALDH1A1CTSDMAPTKDM4EALPL |
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-2012007006-A1 | TRIAZOLO- AND PYRAZOLOQUINAZOLINE DERIVATIVES AS PDE10A ENZYME INHIBITOR | H. LUNDBECK A/S (DK) | 2012-01-19 | — | — | WO | disclosed |