Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.67 |
| ▸ | MAOB | P27338 | 1/20 | 0.67 |
| ▸ | PDE2A | O00408 | 12/20 | 0.67 |
| ▸ | PDE10A | Q9Y233 | 11/20 | 0.67 |
| ▸ | TYMS | P04818 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | CNR2 | P34972 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL14764776 | 0.86 | TYMS (0.70) | MAOAPDE2APDE10ATYMSKDM4E | |
| SCHEMBL14765009 | 0.85 | MAOA (0.62) | MAOAMAOBPDE2APDE10ATYMS | |
| SCHEMBL12502817 | 0.80 | PDE2A (1.00) | PDE2APDE10A | |
| SCHEMBL14054628 | 0.79 | PDE2A (0.68) | PDE2APDE10AALDH1A1 | |
| SCHEMBL12502608 | 0.78 | PDE2A (1.00) | PDE2APDE10A | |
| SCHEMBL14359766 | 0.75 | PDE2A (0.58) | PDE2APDE10ATYMSKDM4EALDH1A1 | |
| SCHEMBL5011775 | 0.74 | ALDH1A1 (0.68) | KDM4EALDH1A1MAPTSMN1; SMN2NPC1 | |
| SCHEMBL12503035 | 0.74 | PDE2A (0.80) | PDE2APDE10A | |
| SCHEMBL14362008 | 0.74 | PDE2A (0.80) | PDE2APDE10A | |
| SCHEMBL14362116 | 0.73 | PDE2A (0.76) | PDE2APDE10ATYMS |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013034755-A1 | TRIAZOLOPYRAZINE DERIVATIVES AND THEIR USE FOR TREATING NEUROLOGICAL AND PSYCHIATRIC DISORDERS | H. LUNDBECK A/S (DK) | 2013-03-14 | — | — | WO | claimed |
| WO-2013034755-A1 | TRIAZOLOPYRAZINE DERIVATIVES AND THEIR USE FOR TREATING NEUROLOGICAL AND PSYCHIATRIC DISORDERS | H. LUNDBECK A/S (DK) | 2013-03-14 | — | — | 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 |