Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | FHIT | P49789 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6505364 | 0.83 | GAA (0.55) | ALDH1A1CYP1A2GAAMEN1KMT2A | |
| SCHEMBL5731466 | 0.80 | ALDH1A1 (0.47) | ALDH1A1CYP1A2GAAMEN1KMT2A | |
| SCHEMBL16705221 | 0.80 | ALDH1A1 (0.47) | ALDH1A1CYP1A2GAAMEN1KMT2A | |
| SCHEMBL1973691 | 0.80 | ALDH1A1 (0.55) | ALDH1A1CYP1A2GAAMEN1KMT2A | |
| SCHEMBL16437812 | 0.79 | ALDH1A1 (0.54) | ALDH1A1CYP1A2GAAHPGDMAPT | |
| SCHEMBL22658875 | 0.78 | ALDH1A1 (0.45) | ALDH1A1CYP1A2GAAMEN1KMT2A | |
| SCHEMBL1968562 | 0.74 | MAPK1 (0.52) | ALDH1A1CYP1A2GAAMEN1KMT2A | |
| SCHEMBL5553648 | 0.72 | ALDH1A1 (0.58) | ALDH1A1CYP1A2MEN1KMT2AHPGD | |
| SCHEMBL9795347 | 0.71 | TRPM8 (0.56) | ALDH1A1CYP1A2MEN1KMT2AHPGD | |
| SCHEMBL29030799 | 0.70 | ALDH1A1 (0.47) | ALDH1A1CYP1A2GAAKMT2AHPGD |
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-1966176-A1 | HETEROCYCLIC GABA-B MODULATORS | AstraZeneca AB (SE) | 2008-09-10 | — | — | EP | claimed |
| WO-2007073296-A1 | HETEROCYCLIC GABA-B MODULATORS | ASTRAZENECA AB (SE) | 2007-06-28 | — | — | WO | claimed |