Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PDE2A | O00408 | 2/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.41 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | CPB1 | P15086 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16454784 | 0.84 | TSHR (0.46) | ALDH1A1NPC1HPGDKDM4ERAB9A | |
| SCHEMBL16454853 | 0.83 | ALDH1A1 (0.46) | ALDH1A1KDM4ECYP2C19TSHRKMT2A | |
| SCHEMBL16454827 | 0.83 | IDO1 (0.48) | ALDH1A1NPC1HPGDKDM4ERAB9A | |
| SCHEMBL16454809 | 0.82 | TSHR (0.53) | ALDH1A1NPC1HPGDRAB9ATSHR | |
| SCHEMBL16454875 | 0.81 | KCNK3 (0.53) | ALDH1A1NPC1HPGDRAB9AL3MBTL1 | |
| SCHEMBL16454869 | 0.81 | KMT2A (0.49) | ALDH1A1NPC1HPGDKDM4ERAB9A | |
| SCHEMBL16454812 | 0.81 | MAPT (0.49) | ALDH1A1NPC1RAB9AKMT2ATP53 | |
| SCHEMBL16454825 | 0.81 | RAB9A (0.46) | ALDH1A1NPC1HPGDKDM4ERAB9A | |
| SCHEMBL16454789 | 0.80 | CHRNA7 (0.44) | ALDH1A1NPC1HPGDKDM4ERAB9A | |
| SCHEMBL16454829 | 0.79 | KCNK3 (0.49) | ALDH1A1NPC1KDM4ERAB9ATSHR |
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 |