Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.75 |
| ▸ | NPC1 | O15118 | 1/20 | 0.68 |
| ▸ | RAB9A | P51151 | 1/20 | 0.68 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.63 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.62 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | BCHE | P06276 | 1/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL230157 | 0.90 | POLB (0.84) | POLBNPC1RAB9ADDAH1CHRM1 | |
| SCHEMBL7854448 | 0.86 | POLB (0.92) | POLBNPC1RAB9ADDAH1CHRM1 | |
| SCHEMBL7006523 | 0.86 | POLB (1.00) | POLBNPC1RAB9ADDAH1CHRM1 | |
| SCHEMBL30701864 | 0.84 | POLB (0.96) | POLBNPC1RAB9ADDAH1CHRM1 | |
| SCHEMBL7854826 | 0.84 | POLB (0.96) | POLBNPC1RAB9ADDAH1CHRM1 | |
| Hydrochloric Acid SCHEMBL8466213 | 0.84 | DDAH1 (0.63) | POLBNPC1RAB9ADDAH1CHRM1 | |
| SCHEMBL30701863 | 0.84 | POLB (0.96) | POLBNPC1RAB9ADDAH1CHRM1 | |
| SCHEMBL7856315 | 0.84 | POLB (0.96) | POLBNPC1RAB9ADDAH1CHRM1 | |
| SCHEMBL7856311 | 0.84 | POLB (0.96) | POLBNPC1RAB9ADDAH1CHRM1 | |
| SCHEMBL2331252 | 0.84 | POLB (0.96) | POLBNPC1RAB9ADDAH1CHRM1 |
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 |