Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8089735 | 0.80 | CYP1A2 (0.35) | CYP1A2HIF1ABRD4HSP90AA1 | |
| SCHEMBL8090185 | 0.78 | KDM4E (0.31) | — | |
| SCHEMBL28038102 | 0.73 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL29253988 | 0.70 | P2RX7 (0.43) | BRD4 | |
| SCHEMBL3709921 | 0.65 | CYP1A2 (0.36) | CYP1A2HIF1ABRD4 | |
| SCHEMBL11660306 | 0.65 | NPSR1 (0.39) | — | |
| SCHEMBL8088015 | 0.63 | SRD5A2 (0.33) | — | |
| SCHEMBL4458335 | 0.62 | ACE (0.47) | BRD4 | |
| SCHEMBL8091518 | 0.62 | TSHR (0.33) | CYP1A2HIF1A | |
| SCHEMBL22220534 | 0.62 | NPSR1 (0.36) | — |
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-2009013535-A1 | 2-AZABICYCLO(2.2.2)OCTANE DERIVATIVES AS MODULATORS OF THE GLYCINE TRANSPORTER I RECEPTOR | ASTRAZENECA AB (SE) | 2009-01-29 | — | — | WO | disclosed |