Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 4/20 | 0.46 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ATM | Q13315 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2458365 | 0.74 | XDH (0.47) | XDHGDASMN1; SMN2KDM4ELMNA | |
| SCHEMBL1776468 | 0.74 | XDH (0.49) | XDHGDASMN1; SMN2KDM4ELMNA | |
| SCHEMBL4253369 | 0.73 | XDH (0.51) | XDHGDASMN1; SMN2KDM4ELMNA | |
| SCHEMBL2457649 | 0.72 | XDH (0.48) | XDHGDASMN1; SMN2KDM4ELMNA | |
| SCHEMBL12017486 | 0.71 | XDH (0.55) | XDHGDASMN1; SMN2KDM4ELMNA | |
| SCHEMBL562980 | 0.70 | XDH (0.67) | XDHGDASMN1; SMN2KDM4ELMNA | |
| SCHEMBL2457645 | 0.70 | XDH (0.46) | XDHGDASMN1; SMN2KDM4ELMNA | |
| SCHEMBL2454438 | 0.70 | ALDH1A1 (0.42) | XDHKDM4ELMNATSHRALDH1A1 | |
| SCHEMBL2458114 | 0.69 | PARP10 (0.41) | XDHSMN1; SMN2LMNATSHRALDH1A1 | |
| SCHEMBL1776355 | 0.69 | XDH (0.47) | XDHGDASMN1; SMN2KDM4ELMNA |
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-B1 | THIOXANTHINE DERIVATIVES AND THEIR USE AS INHIBITORS OF MPO | ASTRAZENECA AB (SE) | 2012-07-11 | — | — | EP | disclosed |
| US-8026244-B2 | Thioxanthine derivatives and their use as inhibitors of MPO | ASTRAZENECA AB (SE) | 2011-09-27 | — | — | US | disclosed |