Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL2585264 | 0.98 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDABCB1GAA | |
| SCHEMBL2593031 | 0.98 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDABCB1GAA | |
| SCHEMBL14736972 | 0.96 | ALDH1A1 (0.40) | ALDH1A1KDM4EHPGDABCB1GAA | |
| SCHEMBL2586035 | 0.94 | ALDH1A1 (0.43) | ALDH1A1KDM4EHPGDABCB1GAA | |
| SCHEMBL2588156 | 0.94 | KDM4E (0.43) | ALDH1A1KDM4EHPGDABCB1GAA | |
| SCHEMBL2591586 | 0.93 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDABCB1GAA | |
| SCHEMBL14736986 | 0.93 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDABCB1GAA | |
| SCHEMBL2591451 | 0.93 | ALDH1A1 (0.41) | ALDH1A1KDM4EHPGDABCB1GAA | |
| SCHEMBL14737774 | 0.93 | KDM4E (0.47) | ALDH1A1KDM4EHPGDABCB1GAA | |
| SCHEMBL2591571 | 0.91 | ALDH1A1 (0.38) | ALDH1A1KDM4EHPGDABCB1GAA |
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-2563770-B1 | BIARYL PHOSPHODIESTERASE INHIBITORS | LEO PHARMA AS (DK) | 2016-03-23 | — | — | EP | disclosed |
| 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 |