Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.31 |
| ▸ | GABRD | O14764 | 1/20 | 0.31 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.31 |
| ▸ | ALB | P02768 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5488765 | 0.68 | GABRA5 (0.43) | CYP1A2CYP3A4CYP2C9MAPK1CYP2C19 | |
| SCHEMBL6626686 | 0.67 | MDM2 (0.33) | — | |
| SCHEMBL5493513 | 0.67 | GABRA5 (0.41) | GABRA5 | |
| SCHEMBL7413954 | 0.66 | CYP1A2 (0.56) | CYP1A2CYP3A4CYP2C9MAPK1CYP2C19 | |
| SCHEMBL5489020 | 0.66 | PDE2A (0.58) | PDE2ACYP3A4GABRPGABRDCACNA1F | |
| SCHEMBL5493370 | 0.65 | PDE2A (0.48) | PDE2AGABRPGABRDCACNA1FALB | |
| SCHEMBL5494671 | 0.64 | GABRA5 (0.43) | CYP1A2CYP3A4CYP2C9MAPK1CYP2C19 | |
| SCHEMBL5489993 | 0.64 | CA1 (0.39) | CYP1A2CYP3A4CYP2C9MAPK1CYP2C19 | |
| SCHEMBL4708082 | 0.64 | LMNA (0.60) | PDE2AGABRPGABRDCACNA1FALB | |
| SCHEMBL5490129 | 0.63 | MDM2 (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 |