Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 1/20 | 0.59 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.59 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.59 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.59 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 2/20 | 0.43 |
| ▸ | GABRP | O00591 | 1/20 | 0.43 |
| ▸ | GABRD | O14764 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.43 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.43 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.43 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.43 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9256388 | 0.89 | ADORA3 (0.55) | MAP4K4TAOK1PBKSLKADORA2A | |
| SCHEMBL9255705 | 0.87 | ADORA1 (0.51) | MAP4K4TAOK1PBKSLKADORA2A | |
| SCHEMBL9265209 | 0.87 | POLB (0.48) | MAP4K4TAOK1PBKSLKADORA3 | |
| SCHEMBL9264849 | 0.86 | MAP4K4 (0.54) | MAP4K4TAOK1PBKSLKADORA2A | |
| SCHEMBL9256089 | 0.81 | ADORA3 (0.54) | MAP4K4ADORA2AADORA3POLBKDM4E | |
| SCHEMBL9261950 | 0.79 | ADORA3 (0.49) | MAP4K4TAOK1PBKSLKADORA3 | |
| SCHEMBL9262896 | 0.79 | ADORA3 (0.49) | MAP4K4TAOK1PBKSLKADORA3 | |
| SCHEMBL9258369 | 0.76 | POLB (0.48) | ADORA3POLBPARP1GABRA1GABRA5 | |
| SCHEMBL9262609 | 0.76 | DCLK1 (0.65) | MAP4K4ADORA2AADORA3RAB9AGABRA1 | |
| SCHEMBL9538661 | 0.76 | NPC1 (0.50) | MAP4K4TAOK1PBKSLKADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993004066-A1 | CERTAIN IMIDAZOQUINOXALINOLS; A NEW CLASS OF GABA BRAIN RECEPTOR LIGANDS | NEUROGEN CORPORATION (US) | 1993-03-04 | — | — | WO | claimed |
| US-5182386-A | G-Aminobutyric Acid | NEUROGEN CORPORATION (US) | 1993-01-26 | — | — | US | claimed |
| 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 |