Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 2/20 | 0.39 |
| ▸ | PLAT | P00750 | 2/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5484469 | 0.96 | CYP1A2 (0.43) | NR1H4ALDH1A1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5486696 | 0.87 | CYP1A2 (0.47) | ALDH1A1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5492316 | 0.87 | ALDH1A1 (0.53) | ALDH1A1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5486160 | 0.86 | MAPK1 (0.46) | ALDH1A1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5490322 | 0.82 | CYP1A2 (0.46) | ALDH1A1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5492933 | 0.79 | TDP2 (0.47) | ALDH1A1CYP1A2CYP3A4CYP2C9MAPK1 | |
| SCHEMBL5484921 | 0.79 | CYP1A2 (0.50) | ALDH1A1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5488285 | 0.78 | TDP2 (0.46) | LMNACYP1A2CYP3A4CYP2C9MAPK1 | |
| SCHEMBL5493764 | 0.78 | MAPK1 (0.49) | ALDH1A1LMNACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5484416 | 0.77 | CYP11B1 (0.47) | CYP1A2CYP3A4CYP2C9MAPK1CYP2C19 |
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-1392663-A2 | CYCLIC NUCLEOTIDE PHOSPHODIESTERASE INHIBITORS, PREPARATION AND USES THEREOF | NEURO3D (FR) | 2004-03-03 | — | — | EP | claimed |
| WO-2002098865-A2 | CYCLIC NUCLEOTIDE PHOSPHODIESTERASE INHIBITORS, PREPARATION AND USES THEREOF | NEURO3D (FR) | 2002-12-12 | — | — | WO | claimed |