Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CASP1 | P29466 | 1/20 | 0.52 |
| ▸ | CASP7 | P55210 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12013388 | 0.89 | HTT (0.47) | ALDH1A1KDM4EHPGDGLAGAA | |
| SCHEMBL8543822 | 0.88 | CASP1 (0.52) | ALDH1A1KDM4EHPGDGLAGAA | |
| SCHEMBL8544863 | 0.88 | KDM4E (0.58) | ALDH1A1KDM4EHPGDGLAGAA | |
| SCHEMBL8550054 | 0.87 | SLC22A12 (0.44) | ALDH1A1KDM4EHPGDGLAGAA | |
| SCHEMBL8308344 | 0.87 | ALDH1A1 (0.47) | ALDH1A1KDM4EHPGDGLAGAA | |
| SCHEMBL679245 | 0.86 | ALDH1A1 (0.46) | ALDH1A1KDM4EHPGDGLAGAA | |
| SCHEMBL8837860 | 0.86 | KDM4E (0.52) | ALDH1A1KDM4EHPGDGLAGAA | |
| SCHEMBL8551230 | 0.84 | ALDH1A1 (0.44) | ALDH1A1KDM4EHPGDNPSR1MAPT | |
| SCHEMBL5964314 | 0.83 | HTT (0.46) | ALDH1A1KDM4EHPGDNPSR1MAPT | |
| SCHEMBL8307013 | 0.82 | ALDH1A1 (0.45) | ALDH1A1KDM4EHPGDGLAGAA |
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-2068872-A1 | COMBINATIONS CONTAINING A 4-ACYLAMINOPYRIDINE DERIVATIVE | Braincells, Inc. (US) | 2009-06-17 | — | — | EP | disclosed |
| WO-2008030651-A1 | COMBINATIONS CONTAINING A 4-ACYLAMINOPYRIDINE DERIVATIVE | BRAINCELLS, INC. (US) | 2008-03-13 | — | — | WO | disclosed |