Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 3/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14737131 | 0.93 | ALDH1A1 (0.42) | ALDH1A1KDM4EHPGDCYP1A2CYP3A4 | |
| SCHEMBL2592126 | 0.93 | KDM4E (0.31) | ALDH1A1KDM4EHPGD | |
| SCHEMBL2588635 | 0.92 | ALDH1A1 (0.42) | ALDH1A1KDM4EHPGDKMT2APDE4D | |
| SCHEMBL14737453 | 0.91 | ALDH1A1 (0.43) | ALDH1A1KDM4EHPGDCYP1A2CYP3A4 | |
| SCHEMBL14737100 | 0.91 | ALDH1A1 (0.44) | ALDH1A1KDM4EHPGDCYP3A4KMT2A | |
| SCHEMBL14737827 | 0.88 | ALDH1A1 (0.43) | ALDH1A1KDM4EHPGDKMT2APDE4D | |
| SCHEMBL14736935 | 0.86 | ALDH1A1 (0.45) | ALDH1A1KDM4EHPGDCYP1A2CYP3A4 | |
| SCHEMBL2589773 | 0.86 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDKMT2APDE4D | |
| SCHEMBL14737120 | 0.85 | ALDH1A1 (0.42) | ALDH1A1KDM4EHPGDCYP1A2CYP3A4 | |
| SCHEMBL14737124 | 0.85 | ALDH1A1 (0.42) | ALDH1A1KDM4EHPGDCYP1A2CYP3A4 |
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-2563770-A1 | BIARYL PHOSPHODIESTERASE INHIBITORS | Leo Pharma A/S (DK) | 2013-03-06 | — | — | EP | disclosed |
| WO-2011134468-A1 | BIARYL PHOSPHODIESTERASE INHIBITORS | LEO PHARMA A/S (DK) | 2011-11-03 | — | — | WO | disclosed |