Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | HTR1A | P08908 | 1/20 | 0.59 |
| ▸ | MAOA | P21397 | 1/20 | 0.59 |
| ▸ | MAOB | P27338 | 1/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.59 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL3281638 | 0.93 | ALDH1A1 (0.67) | ALDH1A1KDM4ETSHRCYP2D6HTR1A | |
| Hydrochloric Acid SCHEMBL3282645 | 0.83 | SMN1; SMN2 (0.49) | SMN1; SMN2ALDH1A1KDM4ETSHRCYP2D6 | |
| Eprobemide SCHEMBL570896 | 0.83 | ALDH1A1 (0.85) | SMN1; SMN2ALDH1A1KDM4ETSHRCYP2D6 | |
| SCHEMBL5224286 | 0.82 | MAPK14 (0.51) | SMN1; SMN2ALDH1A1KDM4ETSHR | |
| Eprobemide SCHEMBL10495496 | 0.82 | ALDH1A1 (0.82) | SMN1; SMN2ALDH1A1KDM4ETSHRHTR1A | |
| Morpholine SCHEMBL3317371 | 0.81 | SMN1; SMN2 (0.54) | SMN1; SMN2ALDH1A1KDM4ETSHRCYP2D6 | |
| SCHEMBL29672523 | 0.80 | SMN1; SMN2 (0.72) | SMN1; SMN2ALDH1A1KDM4ETSHRCYP2D6 | |
| SCHEMBL1382764 | 0.80 | SMN1; SMN2 (0.95) | SMN1; SMN2ALDH1A1KDM4ETSHRCD274 | |
| SCHEMBL23139667 | 0.80 | ALDH1A1 (0.64) | SMN1; SMN2ALDH1A1KDM4ETSHRCYP2D6 | |
| SCHEMBL2739971 | 0.79 | POLB (0.69) | SMN1; SMN2ALDH1A1KDM4ETSHRCYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1664025-B1 | PYRROL DERIVATIVES WITH ANTIBACTERIAL ACTIVITY | ASTRAZENECA AB (SE) | 2007-09-19 | — | — | EP | disclosed |
| EP-1664025-A1 | PYRROL DERIVATIVES WITH ANTIBACTERIAL ACTIVITY | AstraZeneca AB (SE) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005026149-A1 | PYRROL DERIVATIVES WITH ANTIBACTERIAL ACTIVITY | ASTRAZENECA AB (SE) | 2005-03-24 | — | — | WO | disclosed |