Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 3/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3405851 | 0.86 | APP (0.64) | APPKDM4EPOLBMAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL30779103 | 0.84 | APP (0.63) | APPKDM4EPOLBMAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL968484 | 0.84 | APP (0.63) | APPKDM4EPOLBMAPTALDH1A1 | |
| SCHEMBL1269440 | 0.81 | APP (0.63) | APPKDM4EPOLBMAPTALDH1A1 | |
| SCHEMBL27913898 | 0.81 | APP (0.55) | APPKDM4EPOLBMAPTALDH1A1 | |
| SCHEMBL5935797 | 0.80 | LMNA (0.62) | APPKDM4EPOLBMAPTALDH1A1 | |
| SCHEMBL11148883 | 0.80 | LMNA (0.62) | APPKDM4EPOLBMAPTALDH1A1 | |
| SCHEMBL29184950 | 0.80 | LMNA (0.62) | APPKDM4EPOLBMAPTALDH1A1 | |
| Calcium SCHEMBL2689056 | 0.80 | APP (0.61) | APPKDM4EPOLBMAPTALDH1A1 | |
| SCHEMBL27684582 | 0.80 | LMNA (0.62) | APPKDM4EPOLBMAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2010535-A1 | THIOXANTHINE DERIVATIVES AND THEIR USE AS INHIBITORS OF MPO | AstraZeneca AB (SE) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007120098-A1 | THIOXANTHINE DERIVATIVES AND THEIR USE AS INHIBITORS OF MPO | ASTRAZENECA AB (SE) | 2007-10-25 | — | — | WO | disclosed |