Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 6/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16454819 | 0.83 | HPGD (0.54) | HPGDALDH1A1HTTGAAPKM | |
| SCHEMBL16454825 | 0.79 | RAB9A (0.46) | HPGDALDH1A1KDM4EHSD17B10NPC1 | |
| SCHEMBL16454785 | 0.79 | ALDH1A1 (0.52) | HPGDALDH1A1HTTPKMKDM4E | |
| SCHEMBL16454824 | 0.75 | NPC1 (0.56) | HPGDALDH1A1GAAKDM4ENPC1 | |
| SCHEMBL16454876 | 0.74 | NPC1 (0.55) | HPGDALDH1A1HTTGAAPKM | |
| SCHEMBL16454813 | 0.74 | PDE2A (0.48) | HPGDALDH1A1KDM4EHSD17B10NPC1 | |
| SCHEMBL16454859 | 0.70 | ALDH1A1 (0.53) | HPGDALDH1A1HTTGAAPKM | |
| SCHEMBL16454874 | 0.70 | ALDH1A1 (0.46) | HPGDALDH1A1HTTKDM4ETSHR | |
| SCHEMBL16454801 | 0.69 | MAPT (0.50) | GAAKDM4ETSHRHSD17B10NPC1 | |
| SCHEMBL16454880 | 0.69 | MAPT (0.55) | ALDH1A1TSHRHSD17B10MAPTKMT2A |
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 |