Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.51 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.39 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.38 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | LPAR1 | Q92633 | 3/20 | 0.37 |
| ▸ | LPAR5 | Q9H1C0 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6867557 | 0.90 | ADORA2A (0.46) | ADORA2ALIMK1LIMK2GAAHPGD | |
| SCHEMBL6869952 | 0.90 | ADORA2A (0.52) | ADORA2AMEN1KMT2AMAPTKDM4E | |
| SCHEMBL6872977 | 0.81 | ADORA2A (0.51) | ADORA2ARCE1PIN1MEN1KMT2A | |
| SCHEMBL6863393 | 0.78 | ADORA2A (0.50) | ADORA2ARCE1CYP3A4LPAR1LPAR5 | |
| SCHEMBL6867466 | 0.78 | ADORA2A (0.49) | ADORA2AKDM4EALDH1A1HPGD | |
| SCHEMBL6870680 | 0.75 | ADORA2A (0.60) | ADORA2AKMT2AMAPTKDM4EALDH1A1 | |
| SCHEMBL6873020 | 0.73 | ADORA2A (0.53) | ADORA2ALIMK1LIMK2KDM4EGAA | |
| SCHEMBL6873024 | 0.72 | ADORA2A (0.75) | ADORA2AMEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL6863049 | 0.72 | ADORA2A (0.45) | ADORA2ACYP3A4MEN1KMT2AMAPT | |
| SCHEMBL6863726 | 0.72 | ADORA2A (0.56) | ADORA2AMAPTKDM4EALDH1A1LMNA |
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 |