Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ELANE | P08246 | 6/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.36 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4328036 | 0.86 | ALDH1A1 (0.46) | KDM4EALDH1A1ELANEHCRTR1HCRTR2 | |
| SCHEMBL4335675 | 0.85 | KDM4E (0.41) | KDM4EALDH1A1ELANEHCRTR1HCRTR2 | |
| SCHEMBL5312401 | 0.81 | ELANE (0.46) | KDM4EALDH1A1ELANESLC22A12HTT | |
| SCHEMBL4332795 | 0.80 | SLC22A12 (0.45) | ALDH1A1ELANEHCRTR1HCRTR2SLC22A12 | |
| SCHEMBL4339542 | 0.79 | HCRTR1 (0.45) | ALDH1A1HCRTR1HCRTR2TSHR | |
| SCHEMBL5410899 | 0.79 | PDE4D (0.41) | HCRTR1HCRTR2 | |
| SCHEMBL13666652 | 0.79 | ELANE (0.54) | ELANEAAK1KMT2A | |
| SCHEMBL4330156 | 0.78 | PDE4D (0.41) | — | |
| SCHEMBL4333003 | 0.78 | ELANE (0.46) | KDM4EALDH1A1ELANEAAK1HTT | |
| SCHEMBL13666656 | 0.77 | MAPT (0.46) | KDM4EALDH1A1ELANEHCRTR1SLC22A12 |
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-1786813-A2 | BICYCLIC HETEROARYL PDE4B INHIBITORS | PLEXXIKON, INC. (US) | 2007-05-23 | — | — | EP | disclosed |
| WO-2006026754-A2 | BICYCLIC HETEROARYL PDE4B INHIBITORS | PLEXXIKON, INC. (US) | 2006-03-09 | — | — | WO | disclosed |