Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.49 |
| ▸ | MAPK8 | P45983 | 7/20 | 0.48 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.47 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.47 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.47 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.46 |
| ▸ | CDK2 | P24941 | 2/20 | 0.46 |
| ▸ | PDE2A | O00408 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.43 |
| ▸ | MBNL1 | Q9NR56 | 1/20 | 0.42 |
| ▸ | RAD51 | Q06609 | 3/20 | 0.41 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11493551 | 0.83 | MAPK8 (0.50) | ADORA2AMAPK8HTR3EHTR3BHTR3A | |
| SCHEMBL11491773 | 0.82 | MAPK8 (0.46) | MAPK8HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11420865 | 0.80 | ALDH1A1 (0.55) | ADORA2AMAPK8HTR3EHTR3BHTR3A | |
| SCHEMBL11417540 | 0.79 | MAPK8 (0.55) | ADORA2AMAPK8HTR3EHTR3BHTR3A | |
| SCHEMBL11491311 | 0.79 | RECQL (0.49) | MAPK8HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11485561 | 0.77 | RAD51 (0.47) | ADORA2AMAPK8HTR3EHTR3BHTR3A | |
| SCHEMBL11493554 | 0.77 | MAPK8 (0.52) | MAPK8HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11484873 | 0.75 | MAPK8 (0.48) | MAPK8HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11460178 | 0.75 | LCK (0.61) | MAPK8HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL11495421 | 0.74 | RAD51 (0.65) | MAPK8HTR3EHTR3BHTR3AHTR3D |
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-5473073-A | Useful in diagnosis or treatment of anxiety, sleep and seizure disorders, overdose with bezodiazepine drug and memory enhancement | NEUROGEN CORPORATION (US) | 1995-12-05 | — | — | US | disclosed |
| WO-1993004066-A1 | CERTAIN IMIDAZOQUINOXALINOLS; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS | NEUROGEN CORPORATION (US) | 1993-03-04 | — | — | WO | disclosed |
| US-5182386-A | G-Aminobutyric Acid | NEUROGEN CORPORATION (US) | 1993-01-26 | — | — | US | disclosed |