Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.47 |
| ▸ | HTR1A | P08908 | 5/20 | 0.47 |
| ▸ | DRD2 | P14416 | 5/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9297541 | 0.87 | HTR2A (0.61) | HTR2AHTR1ADRD2ADRA1ADRD4 | |
| SCHEMBL7990156 | 0.80 | HTR2A (0.51) | HTR2AHTR1ADRD2HTR2CADRA1A | |
| Fumaric Acid SCHEMBL7990225 | 0.75 | HTR2A (0.45) | HTR2AHTR1ADRD2HTR2CADRA1A | |
| Maleic Acid SCHEMBL7990218 | 0.75 | HTR2A (0.45) | HTR2AHTR1ADRD2HTR2CADRA1A | |
| Maleic Acid SCHEMBL7993166 | 0.74 | HTR2A (0.46) | HTR2AHTR1ADRD2HTR2CADRA1A | |
| Fumaric Acid SCHEMBL7993170 | 0.74 | HTR2A (0.46) | HTR2AHTR1ADRD2HTR2CADRA1A | |
| SCHEMBL7993408 | 0.74 | HTR2A (0.65) | HTR2AHTR1ADRD2ADRA1ADRD4 | |
| SCHEMBL9380372 | 0.72 | HTR1A (0.50) | HTR2AHTR1ADRD2ADRA1AHRH1 | |
| SCHEMBL9381448 | 0.72 | HTR1A (0.76) | HTR2AHTR1ADRD2ADRA1ADRD4 | |
| Hydrochloric Acid SCHEMBL9380816 | 0.71 | HTR1A (0.74) | HTR2AHTR1ADRD2DRD4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6284775-B1 | PSYCHOLOGICAL DISORDERS | AVENTIS PHARMACEUTICALS INC. | 2001-09-04 | — | — | US | disclosed |
| US-5371087-A | Antipsychotic, analgesics, anticonvulsant and anxiolytic agent | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1994-12-06 | — | — | US | disclosed |
| US-5229388-A | 3-[4-(1-substituted-4-piperazinyl)butyl]-4-thiazolidinone and related compounds | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1993-07-20 | — | — | US | disclosed |