Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 2/20 | 0.36 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.36 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PKMYT1 | Q99640 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14764541 | 0.93 | ALDH1A1 (0.37) | MAPTALDH1A1KDM4EPOLBRAB9A | |
| SCHEMBL14764362 | 0.83 | MAPT (0.42) | MAPTALDH1A1KDM4EPOLBRAB9A | |
| SCHEMBL14764490 | 0.80 | ALDH1A1 (0.41) | MAPTALDH1A1KDM4EPOLBRAB9A | |
| SCHEMBL30217623 | 0.80 | MAPT (0.44) | MAPTALDH1A1KDM4EBACE1PKMYT1 | |
| SCHEMBL2513088 | 0.80 | MAPT (0.44) | MAPTALDH1A1KDM4EBACE1PKMYT1 | |
| SCHEMBL14764689 | 0.78 | NQO2 (0.56) | MAPTALDH1A1KDM4EPOLBRAB9A | |
| SCHEMBL27763044 | 0.77 | TDP1 (0.41) | MAPTALDH1A1POLBRAB9ABACE1 | |
| SCHEMBL12503018 | 0.76 | MAPT (0.58) | MAPTALDH1A1KDM4EPOLBRAB9A | |
| SCHEMBL14764430 | 0.76 | MAPT (0.41) | MAPTALDH1A1KDM4EPOLBRAB9A | |
| SCHEMBL15230796 | 0.74 | PIM1 (0.50) | — |
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-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 |