Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.47 |
| ▸ | DRD2 | P14416 | 3/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
| ▸ | HTR1A | P08908 | 3/20 | 0.46 |
| ▸ | HTR2A | P28223 | 3/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8552021 | 0.88 | MEN1 (0.48) | MEN1KMT2AHRH3DRD2DRD3 | |
| SCHEMBL8558649 | 0.82 | HRH3 (0.47) | MEN1KMT2AHRH3DRD2DRD3 | |
| SCHEMBL9597499 | 0.81 | HTR1A (0.52) | MEN1KMT2ADRD2DRD3HTR1A | |
| SCHEMBL9597973 | 0.79 | HTR1A (0.47) | DRD2DRD3HTR1AHTR2AADRA1A | |
| SCHEMBL9018047 | 0.79 | DRD4 (0.57) | DRD2DRD3HTR1AHTR2AADRA1A | |
| SCHEMBL8557739 | 0.78 | HRH3 (0.48) | HRH3HTR1AHTR2A | |
| SCHEMBL8558745 | 0.76 | HRH3 (0.46) | HRH3DRD2HTR1AHTR2AADRA1A | |
| SCHEMBL13380211 | 0.74 | CYP2D6 (0.64) | MEN1KMT2ADRD2DRD3HTR1A | |
| SCHEMBL8556614 | 0.74 | HRH3 (0.66) | HRH3DRD2HTR1AHTR2AKDM4E | |
| SCHEMBL1545412 | 0.73 | DRD2 (0.60) | DRD2HTR1AHTR2AADRA1AHTR2C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0587048-B1 | Heteroarenylpiperazines, a process for their preparation and their use as medicaments | HOECHST MARION ROUSSEL INC (US) | 1998-11-25 | — | — | EP | disclosed |
| EP-0587048-A2 | Heteroarenylpiperazines, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1994-03-16 | — | — | EP | disclosed |
| US-5272148-A | Heteroarenylpiperazines | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1993-12-21 | — | — | US | disclosed |