Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 2/20 | 0.51 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.49 |
| ▸ | NAMPT | P43490 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13055402 | 0.89 | CYP17A1 (0.59) | CYP17A1PSMB8NAMPTGAAALDH1A1 | |
| SCHEMBL14518047 | 0.86 | GAA (0.50) | GAAMEN1NPC1RAB9AKMT2A | |
| SCHEMBL28578217 | 0.86 | GAA (0.54) | GAAMEN1NPC1RAB9AKMT2A | |
| SCHEMBL437131 | 0.85 | CYP17A1 (0.54) | CYP17A1PSMB8NAMPTGAAMEN1 | |
| SCHEMBL1455948 | 0.85 | CYP17A1 (0.54) | CYP17A1PSMB8NAMPTGAAMEN1 | |
| SCHEMBL24865580 | 0.84 | GAA (0.53) | GAAMEN1NPC1RAB9AKMT2A | |
| SCHEMBL13167921 | 0.84 | GAA (0.54) | GAAMEN1NPC1RAB9AKMT2A | |
| SCHEMBL15600499 | 0.84 | GAA (0.47) | CYP17A1PSMB8GAAMEN1NPC1 | |
| SCHEMBL31606832 | 0.84 | GAA (0.50) | GAAMEN1NPC1RAB9AKMT2A | |
| SCHEMBL2227784 | 0.84 | GAA (0.47) | CYP17A1GAAMEN1NPC1RAB9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1070490-C | Indole derivatives | GLAXO WELLCOME SPA (IT) | 2001-09-05 | — | — | CN | disclosed |
| US-6100289-A | ADMINISTERING AN ANALGESIC AMOUNT OF EXCITATORY AMINO ACID ANTAGONIST TO MAMMAL | GLAXO WELLCOME SPA (IT) | 2000-08-08 | — | — | US | disclosed |
| US-5962496-A | CENTRAL NERVOUS SYSTEM DISORDERS | GLAXO WELLCOME SPA (IT) | 1999-10-05 | — | — | US | disclosed |
| US-5760059-A | ANTAGONISTS OF EXCITATORY AMINO ACIDS, TREATMENT OF NEURODEGENERATIVE DISEASES | GLAXO WELLCOME SPA (IT) | 1998-06-02 | — | — | US | disclosed |
| CN-1133042-A | Indole derivatives as NMDA antagonists | GLAXO SPA (IT) | 1996-10-09 | — | — | CN | disclosed |