Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4454521 | 0.93 | MGLL (0.44) | GAAALDH1A1KMT2AMGLLKDM4E | |
| SCHEMBL4471375 | 0.87 | GAA (0.61) | GAAALDH1A1KMT2AMTNR1AMTNR1B | |
| SCHEMBL4471377 | 0.85 | GAA (0.52) | GAAALDH1A1KMT2AKDM4ELMNA | |
| SCHEMBL4488530 | 0.79 | MGLL (0.48) | GAAALDH1A1MGLLKDM4ELMNA | |
| SCHEMBL4460460 | 0.78 | MAPT (0.51) | GAAALDH1A1KMT2AMTNR1AMTNR1B | |
| SCHEMBL4465659 | 0.78 | KMT2A (0.43) | GAAALDH1A1KMT2AKDM4ELMNA | |
| SCHEMBL4501815 | 0.77 | MEN1 (0.47) | GAAALDH1A1KMT2AMGLLKDM4E | |
| SCHEMBL4456810 | 0.76 | CA12 (0.41) | GAAALDH1A1KMT2AMGLLKDM4E | |
| SCHEMBL4455334 | 0.73 | GAA (0.42) | GAAKDM4ELMNA | |
| SCHEMBL4499372 | 0.73 | NSD2 (0.39) | GAAALDH1A1KMT2AKDM4ELMNA |
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-2010534-A1 | THIOXANTHINE DERIVATIVES AND THEIR USE AS INHIBITORS OF MPO | AstraZeneca AB (SE) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007120097-A1 | THIOXANTHINE DERIVATIVES AND THEIR USE AS INHIBITORS OF MPO | ASTRAZENECA AB (SE) | 2007-10-25 | — | — | WO | disclosed |