Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | CTSB | P07858 | 1/20 | 0.54 |
| ▸ | ERN1 | O75460 | 1/20 | 0.51 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.49 |
| ▸ | APP | P05067 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CRHBP | P24387 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL51277 | 0.85 | GPR35 (0.60) | GPR35ALDH1A1TSHRTP53HPGD | |
| SCHEMBL4231830 | 0.83 | ALDH1A1 (0.58) | GPR35ALDH1A1TSHRTP53HPGD | |
| SCHEMBL216753 | 0.83 | GPR35 (0.58) | GPR35ALDH1A1TSHRTP53HPGD | |
| SCHEMBL786832 | 0.81 | GAA (0.59) | GPR35ALDH1A1TSHRTP53HPGD | |
| Hydrochloric Acid SCHEMBL22773531 | 0.81 | GPR35 (0.56) | GPR35ALDH1A1TSHRTP53HPGD | |
| SCHEMBL360284 | 0.81 | TSHR (0.56) | GPR35ALDH1A1TSHRTP53HPGD | |
| SCHEMBL131912 | 0.81 | GPR35 (0.56) | GPR35ALDH1A1TSHRTP53HPGD | |
| SCHEMBL786831 | 0.81 | ALDH1A1 (0.56) | GPR35ALDH1A1TSHRTP53HPGD | |
| SCHEMBL15283303 | 0.81 | ALDH1A1 (0.56) | GPR35ALDH1A1TSHRTP53HPGD | |
| SCHEMBL4653359 | 0.81 | GPR35 (0.56) | GPR35ALDH1A1TSHRTP53HPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012153225-A1 | IMPROVED PROCESSES FOR OBTAINING HIGH PURITY OF DRONEDARONE HYDROCHLORIDE | ALEMBIC PHARMACEUTICALS LIMITED (IN) | 2012-11-15 | — | — | WO | disclosed |
| WO-2007064661-A2 | BIFUNCTIONAL METAL CHELATING CONJUGATES | MALLINCKRODT INC. (US) | 2007-06-07 | — | — | WO | disclosed |