Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 8/20 | 0.53 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.53 |
| ▸ | HTR3E | A5X5Y0 | 4/20 | 0.53 |
| ▸ | HTR3B | O95264 | 4/20 | 0.53 |
| ▸ | HTR3D | Q70Z44 | 4/20 | 0.53 |
| ▸ | HTR3C | Q8WXA8 | 4/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | THPO | P40225 | 1/20 | 0.53 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | NSD2 | O96028 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL20377780 | 0.87 | SMPD3 (0.48) | HRH4KDM4EALDH1A1PARP1 | |
| SCHEMBL25138077 | 0.74 | HTR3A (0.70) | HTR3AHRH4HTR3EHTR3BHTR3D | |
| SCHEMBL8801291 | 0.70 | HTR3A (0.53) | HTR3AHRH4HTR3EHTR3BHTR3D | |
| SCHEMBL18850559 | 0.70 | SMPD3 (0.52) | HTR3AHRH4HTR3EHTR3BHTR3D | |
| SCHEMBL606721 | 0.69 | HRH3 (1.00) | HTR3AHRH4HTR3EHTR3BHTR3D | |
| SCHEMBL20651331 | 0.69 | HRH4 (0.70) | HTR3AHRH4HTR3EHTR3BHTR3D | |
| SCHEMBL24151603 | 0.69 | HTR3A (0.64) | HTR3AHRH4HTR3EHTR3BHTR3D | |
| SCHEMBL7914443 | 0.69 | RAB9A (0.41) | KDM4EALDH1A1CYP1A2 | |
| SCHEMBL13835404 | 0.68 | PARP1 (0.54) | HTR3AHRH4HTR3EHTR3BHTR3D | |
| SCHEMBL30544690 | 0.68 | HTR3A (0.52) | HTR3AHRH4HRH3KDM4EALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5300498-A | Treating depression, obsessive compulsive disorder | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1994-04-05 | — | — | US | claimed |
| EP-0627432-B1 | 6-Piperazinyl-1H-pyrazolo [3,4-b]pyridine-3-carboxylic Acids, Esters, Amides and related compounds, a process for their preparation and their use as medicaments | HOECHST MARION ROUSSEL INC (US) | 1997-09-03 | — | — | EP | disclosed |
| EP-0627432-A1 | 6-Piperazinyl-1H-pyrazolo [3,4-b]pyridine-3-carboxylic Acids, Esters, Amides andrelated compounds, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1994-12-07 | — | — | EP | disclosed |
| US-5300498-A | Treating depression, obsessive compulsive disorder | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1994-04-05 | — | — | US | disclosed |