Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.50 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.45 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.45 |
| ▸ | AKT2 | P31751 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL2443705 | 0.90 | DPP7 (0.57) | CYP3A4CYP2D6HDAC1DPP7CYP2C19 | |
| SCHEMBL5605518 | 0.84 | SLC2A1 (0.49) | SMN1; SMN2 | |
| SCHEMBL5595644 | 0.83 | CYP3A4 (0.57) | CYP3A4CYP2D6SIGMAR1HDAC1CXCR4 | |
| SCHEMBL9048454 | 0.82 | DPP7 (0.73) | CYP3A4CYP2D6SIGMAR1DPP7CXCR4 | |
| SCHEMBL5604920 | 0.81 | SLC6A4 (0.64) | CYP3A4CYP2D6SIGMAR1HDAC1ALDH1A1 | |
| SCHEMBL2444736 | 0.80 | DPP7 (0.69) | CYP3A4CYP2D6SIGMAR1DPP7ALDH1A1 | |
| SCHEMBL14500262 | 0.80 | DPP7 (0.69) | CYP3A4CYP2D6SIGMAR1DPP7CXCR4 | |
| SCHEMBL5595516 | 0.80 | CHRM2 (0.57) | CYP3A4CYP2D6SIGMAR1CYP2C19CHRM2 | |
| SCHEMBL5595311 | 0.77 | KCNJ1 (0.65) | CYP3A4CYP2D6SIGMAR1HDAC1ALDH1A1 | |
| SCHEMBL5595232 | 0.76 | CYP3A4 (0.47) | CYP3A4CYP2D6SIGMAR1ALDH1A1ALOX15 |
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-1809288-A1 | USE OF 1,4-BIS (3-AMINOALKYL) PIPERAZINE DERIVATIVES IN THE TREATMENT OF NEURODEGENERATIVE DISEASES | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2007-07-25 | — | — | EP | claimed |
| WO-2006051489-A1 | USE OF 1,4-BIS (3-AMINOALKYL) PIPERAZINE DERIVATIVES IN THE TREATMENT OF NEURODEGENERATIVE DISEASES | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2006-05-18 | — | — | WO | claimed |