Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 11/20 | 0.61 |
| ▸ | PDE4B | Q07343 | 11/20 | 0.57 |
| ▸ | PDE4A | P27815 | 8/20 | 0.57 |
| ▸ | PDE4C | Q08493 | 8/20 | 0.57 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8891655 | 0.87 | PDE4B (0.70) | PDE4DPDE4BPDE4APDE4CCYP2B6 | |
| SCHEMBL8888975 | 0.86 | PDE4D (0.70) | PDE4DPDE4BPDE4APDE4CCYP2B6 | |
| SCHEMBL8891532 | 0.86 | PDE4D (0.66) | PDE4DPDE4BPDE4APDE4CCYP2B6 | |
| SCHEMBL8889779 | 0.84 | PDE4D (0.61) | PDE4DPDE4BPDE4APDE4CCYP2B6 | |
| SCHEMBL8888978 | 0.81 | PDE4D (0.65) | PDE4DPDE4BPDE4APDE4CCYP2B6 | |
| SCHEMBL8892009 | 0.80 | PDE4D (0.55) | PDE4DPDE4BPDE4APDE4CCYP2B6 | |
| SCHEMBL8891906 | 0.79 | KDM4E (0.60) | PDE4DPDE4BPDE4APDE4CCYP2B6 | |
| SCHEMBL8891152 | 0.79 | PDE4D (0.62) | PDE4DPDE4BPDE4APDE4CCYP2B6 | |
| SCHEMBL8890956 | 0.79 | KDM4E (0.62) | ALDH1A1KDM4E | |
| SCHEMBL8891135 | 0.78 | PDE4D (0.52) | PDE4DPDE4BPDE4APDE4CCYP2B6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997003967-A1 | SUBSTITUTED AROMATIC COMPOUNDS AND THEIR PHARMACEUTICAL USE | RHONE-POULENC RORER LIMITED (GB) | 1997-02-06 | — | — | WO | claimed |
| WO-1997003967-A1 | SUBSTITUTED AROMATIC COMPOUNDS AND THEIR PHARMACEUTICAL USE | RHONE-POULENC RORER LIMITED (GB) | 1997-02-06 | — | — | WO | disclosed |