Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.53 |
| ▸ | DPP4 | P27487 | 9/20 | 0.53 |
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4780529 | 0.89 | DPP4 (0.55) | ALDH1A1DPP4TSHRMAPTLMNA | |
| SCHEMBL13939514 | 0.86 | DPP4 (0.49) | ALDH1A1DPP4TSHRMAPTLMNA | |
| SCHEMBL13939679 | 0.85 | PCSK9 (0.56) | ALDH1A1DPP4TSHRMAPTLMNA | |
| SCHEMBL4667830 | 0.84 | DPP4 (0.71) | ALDH1A1DPP4TSHRMAPTLMNA | |
| SCHEMBL4667778 | 0.84 | DPP4 (0.71) | ALDH1A1DPP4TSHRMAPTLMNA | |
| SCHEMBL4071429 | 0.84 | DPP4 (0.71) | ALDH1A1DPP4TSHRMAPTLMNA | |
| SCHEMBL13939498 | 0.83 | DPP4 (0.50) | ALDH1A1DPP4TSHRMAPTLMNA | |
| SCHEMBL13938272 | 0.83 | MAOB (0.54) | ALDH1A1DPP4TSHRMAPTLMNA | |
| SCHEMBL13939683 | 0.83 | PCSK9 (0.55) | ALDH1A1DPP4TSHRMAPTLMNA | |
| SCHEMBL13939669 | 0.82 | DPP4 (0.52) | ALDH1A1DPP4TSHRMAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-7495004-B2 | Purine derivatives as liver X receptor agonists | GLAXO GROUP LIMITED (GB) | 2009-02-24 | — | — | US | disclosed |