Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.54 |
| ▸ | DRD3 | P35462 | 1/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | RAD52 | P43351 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 3/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.46 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.45 |
| ▸ | HTR3B | O95264 | 1/20 | 0.45 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.45 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.45 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21448015 | 0.87 | DRD2 (0.63) | DRD2DRD3ADRA2CKDM4EMAPT | |
| SCHEMBL22662669 | 0.83 | KEAP1 (0.47) | KDM4EMAPTPOLBALDH1A1GAA | |
| SCHEMBL5092052 | 0.81 | KEAP1 (0.50) | KDM4EPOLBALDH1A1NPSR1 | |
| SCHEMBL29931924 | 0.81 | KEAP1 (0.50) | KDM4EPOLBALDH1A1NPSR1 | |
| SCHEMBL29512667 | 0.81 | ALDH1A1 (0.39) | DRD2DRD3ADRA2CHTR3AALDH1A1 | |
| Hydrochloric Acid SCHEMBL23043631 | 0.80 | KEAP1 (0.48) | KDM4EMAPTPOLBALDH1A1GAA | |
| SCHEMBL21599144 | 0.80 | DRD2 (0.56) | DRD2DRD3ADRA2CHTR3AHTR3E | |
| Hydrochloric Acid SCHEMBL29978819 | 0.80 | KEAP1 (0.48) | KDM4EMAPTPOLBALDH1A1GAA | |
| SCHEMBL20180553 | 0.80 | DRD2 (0.56) | DRD2DRD3ADRA2CKDM4EMAPT | |
| SCHEMBL29512615 | 0.79 | ALDH1A1 (0.44) | PTPN11ALDH1A1 |
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-1998031669-A1 | NOVEL ARYLPIPERAZINE DERIVED FROM PIPERIDINE AS ANTIDEPRESSANT MEDICINES | PIERRE FABRE MEDICAMENT (FR) | 1998-07-23 | — | — | WO | disclosed |
| WO-1997014689-A1 | ARYL-PIPERAZINE CYCLIC AMINE DERIVATIVES, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | PIERRE FABRE MEDICAMENT (FR) | 1997-04-24 | — | — | WO | disclosed |