Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.54 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.54 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5496450 | 1.00 | GAA (0.54) | GAAPTGS1AKR1C3AKR1C2ALDH1A1 | |
| SCHEMBL2976618 | 0.93 | GAA (0.60) | GAAALDH1A1NPC1SMN1; SMN2RAB9A | |
| SCHEMBL2976612 | 0.93 | GAA (0.60) | GAAALDH1A1NPC1SMN1; SMN2RAB9A | |
| SCHEMBL5496448 | 0.88 | ALDH1A1 (0.52) | GAAALDH1A1NPC1SMN1; SMN2RAB9A | |
| SCHEMBL5256348 | 0.87 | GAA (0.57) | GAAALDH1A1NPC1SMN1; SMN2RAB9A | |
| SCHEMBL6293793 | 0.82 | ALDH1A1 (0.62) | GAAALDH1A1NPC1SMN1; SMN2RAB9A | |
| SCHEMBL5673785 | 0.82 | ALDH1A1 (0.60) | GAAPTGS1AKR1C3AKR1C2ALDH1A1 | |
| SCHEMBL2593397 | 0.82 | ALDH1A1 (0.60) | GAAPTGS1AKR1C3AKR1C2ALDH1A1 | |
| SCHEMBL5256345 | 0.82 | ALDH1A1 (0.53) | GAAALDH1A1NPC1SMN1; SMN2RAB9A | |
| SCHEMBL2742576 | 0.81 | ALDH1A1 (0.62) | GAAALDH1A1SMN1; SMN2LMNAHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1836174-A2 | ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | AMGEN INC. (US) | 2007-09-26 | — | — | EP | disclosed |
| WO-2006039718-A2 | ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | AMGEN INC (US) | 2006-04-13 | — | — | WO | disclosed |