Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 6/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 4/20 | 0.36 |
| ▸ | HTR3A | P46098 | 3/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.36 |
| ▸ | HTR3B | O95264 | 2/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3029923 | 0.82 | PTGES (0.40) | PTGESHTR4HTR3AHTR3EHTR3B | |
| SCHEMBL3029931 | 0.82 | PTGES (0.40) | PTGESHTR4HTR3AHTR3EHTR3B | |
| SCHEMBL3029927 | 0.82 | PTGES (0.40) | PTGESHTR4HTR3AHTR3EHTR3B | |
| SCHEMBL505533 | 0.78 | IL1B (0.39) | PTGESHTR4HTR3AHTR3EHTR3B | |
| SCHEMBL506421 | 0.75 | PTGES (0.43) | PTGESHTR4HTR3AHTR3EHTR3B | |
| SCHEMBL506419 | 0.75 | PTGES (0.43) | PTGESHTR4HTR3AHTR3EHTR3B | |
| SCHEMBL506420 | 0.75 | PTGES (0.43) | PTGESHTR4HTR3AHTR3EHTR3B | |
| Revexepride SCHEMBL15773835 | 0.75 | HTR4 (0.53) | PTGESHTR4HTR3AHTR3EHTR3B | |
| Revexepride SCHEMBL505587 | 0.75 | HTR4 (0.53) | PTGESHTR4HTR3AHTR3EHTR3B | |
| Revexepride SCHEMBL505586 | 0.75 | HTR4 (0.53) | PTGESHTR4HTR3AHTR3EHTR3B |
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 |
|---|---|---|---|---|---|---|---|
| US-8063070-B2 | Bicyclic benzamides of 3-or 4-substituted 4-(aminomethyl)-piperidine derivatives | JANSSEN PHARMACEUTICA, N.V. (BE) | 2011-11-22 | — | — | US | disclosed |