Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | HCAR3 | P49019 | 6/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.46 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | CRHBP | P24387 | 1/20 | 0.46 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6541574 | 0.89 | ALDH1A1 (0.56) | ALDH1A1HCAR3MAPTKDM4EMEN1 | |
| SCHEMBL6541569 | 0.89 | ALDH1A1 (0.56) | ALDH1A1HCAR3MAPTKDM4EMEN1 | |
| SCHEMBL15822564 | 0.89 | ALDH1A1 (0.56) | ALDH1A1HCAR3MAPTKDM4EMEN1 | |
| SCHEMBL9348638 | 0.84 | ALDH1A1 (0.69) | ALDH1A1HCAR3MAPTKDM4EMAPK1 | |
| SCHEMBL8962619 | 0.84 | ALDH1A1 (0.69) | ALDH1A1HCAR3MAPTKDM4EMAPK1 | |
| SCHEMBL10505373 | 0.84 | ALDH1A1 (0.69) | ALDH1A1HCAR3MAPTKDM4EMAPK1 | |
| SCHEMBL6132129 | 0.84 | ALDH1A1 (0.69) | ALDH1A1HCAR3MAPTKDM4EMAPK1 | |
| SCHEMBL26496466 | 0.84 | ALDH1A1 (0.69) | ALDH1A1HCAR3MAPTKDM4EMAPK1 | |
| SCHEMBL2707255 | 0.83 | HCAR3 (0.61) | ALDH1A1HCAR3MAPTKDM4EABCB1 | |
| SCHEMBL4869095 | 0.82 | HCAR3 (0.54) | ALDH1A1HCAR3MAPTKDM4EABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014139983-A1 | [1,2,4]TRIAZOLO[4,3-A]QUINOXALINES AS DUAL PDE2/PDE10 INHIBITORS | H. LUNDBECK A/S (DK) | 2014-09-18 | — | — | WO | disclosed |
| WO-2013034755-A1 | TRIAZOLOPYRAZINE DERIVATIVES AND THEIR USE FOR TREATING NEUROLOGICAL AND PSYCHIATRIC DISORDERS | H. LUNDBECK A/S (DK) | 2013-03-14 | — | — | WO | disclosed |