Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.53 |
| ▸ | GFER | P55789 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16454893 | 0.83 | NPSR1 (0.55) | GAAMAPTALDH1A1LMNATSHR | |
| SCHEMBL16454891 | 0.81 | NPSR1 (0.53) | GAAMAPTALDH1A1LMNATSHR | |
| SCHEMBL16454892 | 0.80 | NPSR1 (0.52) | GAAGFERMAPTALDH1A1LMNA | |
| SCHEMBL16454857 | 0.79 | ALDH1A1 (0.50) | GAAMAPTALDH1A1LMNATSHR | |
| SCHEMBL16454805 | 0.77 | MAPT (0.50) | GAAMAPTALDH1A1LMNATSHR | |
| SCHEMBL16454882 | 0.77 | SMN1; SMN2 (0.54) | GAAMAPTALDH1A1LMNATSHR | |
| SCHEMBL16454806 | 0.77 | KMT2A (0.49) | GAAMAPTALDH1A1TSHRPOLB | |
| SCHEMBL16454907 | 0.76 | KDM4E (0.48) | GAAMAPTALDH1A1LMNATSHR | |
| SCHEMBL16454817 | 0.76 | POLB (0.48) | MAPTPOLBMEN1KMT2A | |
| SCHEMBL16454908 | 0.75 | ALDH1A1 (0.47) | MAPTALDH1A1LMNATSHRPOLB |
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 |