Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.51 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CCR2 | P41597 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.40 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.40 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.40 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | LDHA | P00338 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3638561 | 0.85 | DAO (0.65) | DAOMCL1ALDH1A1TSHRCCR2 | |
| SCHEMBL29780995 | 0.85 | DAO (0.65) | DAOMCL1ALDH1A1TSHRCCR2 | |
| SCHEMBL28160836 | 0.82 | PLA2G10 (0.54) | DAOMCL1ALDH1A1TSHRCCR2 | |
| SCHEMBL3843739 | 0.78 | DAO (0.46) | DAOMCL1ALDH1A1TSHRCCR2 | |
| SCHEMBL4467286 | 0.76 | DAO (0.47) | DAOMCL1ALDH1A1TSHRCCR2 | |
| SCHEMBL5967722 | 0.74 | MCL1 (0.49) | DAOMCL1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL30343692 | 0.74 | MCL1 (0.49) | DAOMCL1ALDH1A1TSHRCYP1A2 | |
| SCHEMBL3842692 | 0.74 | DAO (0.46) | DAOMCL1ALDH1A1TSHRCCR2 | |
| SCHEMBL17422801 | 0.74 | DAO (0.46) | DAOMCL1ALDH1A1TSHRCCR2 | |
| SCHEMBL3672379 | 0.74 | DAO (0.42) | DAOMCL1ALDH1A1TSHRCCR2 |
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 |