Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.61 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | F12 | P00748 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | PANK1 | Q8TE04 | 1/20 | 0.40 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6871382 | 0.91 | ADORA2A (0.59) | ADORA2AMEN1KMT2AF12NPC1 | |
| SCHEMBL6863385 | 0.86 | MEN1 (0.47) | ADORA2APDGFRBKDRMEN1KMT2A | |
| SCHEMBL6868478 | 0.85 | ADORA2A (0.64) | ADORA2AKDRF12NPC1SMN1; SMN2 | |
| SCHEMBL6867628 | 0.81 | ADORA2A (0.60) | ADORA2AF12 | |
| SCHEMBL6870493 | 0.81 | ADORA2A (0.40) | ADORA2APDGFRBKDRMEN1KMT2A | |
| SCHEMBL6870133 | 0.81 | ADORA2A (0.59) | ADORA2AKMT2AF12POLB | |
| SCHEMBL6869989 | 0.80 | ADORA2A (0.58) | ADORA2AKDRF12NPC1SMN1; SMN2 | |
| SCHEMBL6869803 | 0.79 | ADORA2A (0.41) | ADORA2APDGFRBKDRMEN1KMT2A | |
| SCHEMBL6869707 | 0.79 | KIT (0.44) | ADORA2APDGFRBKDRMEN1KMT2A | |
| SCHEMBL6871448 | 0.79 | ADORA2A (0.65) | ADORA2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |