Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 10/20 | 0.44 |
| ▸ | HTR1D | P28221 | 4/20 | 0.44 |
| ▸ | HTR1B | P28222 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 8/20 | 0.41 |
| ▸ | HTR2A | P28223 | 7/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6017101 | 0.99 | HTR1A (0.43) | HTR1AHTR1DHTR1BKDM4EMAPK1 | |
| Hydrochloric Acid SCHEMBL6017117 | 0.86 | DRD2 (0.47) | HTR1ADRD2HTR2AHTR2CADRA1D | |
| Hydrochloric Acid SCHEMBL6017133 | 0.82 | KDM4E (0.49) | HTR1AHTR1DHTR1BKDM4EDRD2 | |
| SCHEMBL8544808 | 0.81 | MEN1 (0.51) | HTR1ADRD2HTR2AADRA1DADRA1A | |
| SCHEMBL6017293 | 0.81 | HTR1A (0.49) | HTR1ANPSR1DRD2HTR2A | |
| SCHEMBL8550922 | 0.81 | DRD2 (0.51) | NPSR1DRD2ADRA1DADRA1AADRA1B | |
| Hydrochloric Acid SCHEMBL6017322 | 0.80 | CYP2C9 (0.50) | HTR1ADRD2HTR2AADRA1DADRA1A | |
| Hydrochloric Acid SCHEMBL8549807 | 0.80 | HTR1A (0.48) | HTR1ANPSR1DRD2HTR2A | |
| Hydrochloric Acid SCHEMBL8546517 | 0.80 | DRD2 (0.50) | NPSR1DRD2ADRA1DADRA1AADRA1B | |
| SCHEMBL9054635 | 0.80 | DRD2 (0.45) | HTR1AHTR1DHTR1BKDM4EMAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996041802-A1 | NOVEL HETEROAROMATIC PIPERAZINES FOR USE AS DRUGS | PIERRE FABRE MEDICAMENT (FR) | 1996-12-27 | — | — | WO | disclosed |