Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | MTOR | P42345 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 3/20 | 0.39 |
| ▸ | THPO | P40225 | 3/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 7/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 3/20 | 0.38 |
| ▸ | GMNN | O75496 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | HTR1A | P08908 | 5/20 | 0.36 |
| ▸ | DRD2 | P14416 | 5/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4037443 | 0.99 | RAD52 (0.41) | SMN1; SMN2RAD52CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL4037897 | 0.94 | RAD52 (0.41) | SMN1; SMN2RAD52CYP1A2CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL4035920 | 0.93 | RAD52 (0.43) | SMN1; SMN2RAD52CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL4039594 | 0.90 | MEN1 (0.39) | SMN1; SMN2CYP1A2CYP2D6CYP2C19CYP3A4 | |
| SCHEMBL4040369 | 0.90 | LMNA (0.48) | SMN1; SMN2RAD52CYP1A2CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL4037809 | 0.89 | KMT2A (0.40) | SMN1; SMN2RAD52CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL4041467 | 0.89 | CYP3A4 (0.50) | SMN1; SMN2RAD52CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL6335341 | 0.89 | CYP3A4 (0.50) | SMN1; SMN2RAD52CYP1A2CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL4041643 | 0.89 | LMNA (0.49) | SMN1; SMN2RAD52CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL5415706 | 0.88 | KMT2A (0.39) | SMN1; SMN2RAD52CYP1A2CYP2D6CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1284977-B1 | THIENODIBENZOAZULENE COMPOUNDS AS TUMOR NECROSIS FACTOR INHIBITORS | GLAXOSMITHKLINE ZAGREB (HR) | 2009-06-24 | — | — | EP | claimed |