Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 2/20 | 0.54 |
| ▸ | PDE4A | P27815 | 2/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.47 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.47 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6793662 | 0.87 | IKBKB (0.50) | IKBKBPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4848138 | 0.81 | IKBKB (0.61) | IKBKBHTR1ADRD2CYP11B1CYP11B2 | |
| SCHEMBL4847192 | 0.74 | ADORA2A (0.44) | IKBKBPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4847212 | 0.73 | BRD4 (0.39) | PDE4APDE4BPDE4CPDE4DPDE3B | |
| SCHEMBL4855811 | 0.72 | SYK (0.46) | GCK | |
| SCHEMBL4857946 | 0.68 | MET (0.36) | IKBKBPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4849634 | 0.66 | MAPT (0.45) | PDE4APDE4BPDE4CPDE4DMEN1 | |
| SCHEMBL7447577 | 0.66 | MEN1 (0.47) | PDE4APDE4BPDE4CPDE4DMEN1 | |
| SCHEMBL8140217 | 0.65 | ADORA2A (0.50) | MEN1KMT2AADORA2AALDH1A1KDM4E | |
| SCHEMBL7311175 | 0.65 | MAPK1 (0.65) | IKBKBHTR1ADRD2MEN1KMT2A |
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-6828329-B2 | Agonists, antagonists for gamma-aminobutyric acid brain receptors useful in diagnosis and treatment of anxiety depressionm, down syndrome, sleep and seizure disorders | NEUROGEN CORPORATION | 2004-12-07 | — | — | US | claimed |