Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.47 |
| ▸ | KCNK9 | Q9NPC2 | 2/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | SMO | Q99835 | 1/20 | 0.45 |
| ▸ | TOP1 | P11387 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL16454875 | 0.88 | KCNK3 (0.53) | MAPTALDH1A1HTTRAB9ANPC1 | |
| SCHEMBL16454853 | 0.88 | ALDH1A1 (0.46) | MAPTALDH1A1HTTCYP1A2POLB | |
| SCHEMBL16454827 | 0.88 | IDO1 (0.48) | MAPTALDH1A1HTTRAB9ANPC1 | |
| SCHEMBL16454829 | 0.86 | KCNK3 (0.49) | MAPTALDH1A1HTTRAB9ANPC1 | |
| SCHEMBL16454858 | 0.86 | IDO1 (0.52) | MAPTALDH1A1HTTRAB9ANPC1 | |
| SCHEMBL16454784 | 0.85 | TSHR (0.46) | MAPTALDH1A1HTTRAB9ANPC1 | |
| SCHEMBL16454789 | 0.81 | CHRNA7 (0.44) | MAPTALDH1A1HTTRAB9ANPC1 | |
| SCHEMBL16454809 | 0.81 | TSHR (0.53) | MAPTALDH1A1HTTRAB9ANPC1 | |
| SCHEMBL16454874 | 0.81 | ALDH1A1 (0.46) | ALDH1A1HTTRAB9ANPC1KMT2A | |
| SCHEMBL16454869 | 0.80 | KMT2A (0.49) | MAPTALDH1A1HTTRAB9ANPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015020565-A1 | SUBSTITUTED [1,2,4]TRIAZOLO[4,3-A]PYRIDINES EXHIBITING ANTAGONIST PROPERTIES TO ADENOSINE A2A RECEPTORS, AND USE THEREOF | ОБЩЕСТВО С ОГРАНИЧЕННОЙ ОТВЕТСТВЕННОСТЬЮ "НЬЮВАК" (ООО "НЬЮВАК") (RU) | 2015-02-12 | — | — | WO | disclosed |