Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 2/20 | 0.31 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL9966490 | 0.77 | CA1 (0.36) | CYP1A2CYP2D6PDE2AKIF11 | |
| SCHEMBL999658 | 0.76 | CYP1A2 (0.52) | CYP1A2CYP2D6KIF11 | |
| SCHEMBL4809614 | 0.75 | APP (0.39) | APPTSHRPDE2A | |
| Iodide SCHEMBL25236695 | 0.73 | PDE2A (0.48) | APPTSHRPDE2A | |
| SCHEMBL706386 | 0.73 | APP (0.35) | CYP1A2CYP2D6APEX1PMP22APP | |
| SCHEMBL29054525 | 0.72 | ALDH1A1 (0.44) | TP53TSHR | |
| SCHEMBL5758950 | 0.71 | APP (0.37) | APPTSHRPDE2AKIF11 | |
| SCHEMBL13141988 | 0.69 | ESR1 (0.52) | CYP1A2APPTP53TSHR | |
| SCHEMBL15108873 | 0.69 | APP (0.42) | APPTSHRKIF11 | |
| SCHEMBL1538300 | 0.69 | APP (0.42) | APPTSHRPDE2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4360511-A | Amines useful as brain imaging agents | MEDI-PHYSICS, INC. (US) | 1982-11-23 | — | — | US | claimed |
| US-4360511-A | Amines useful as brain imaging agents | MEDI-PHYSICS, INC. (US) | 1982-11-23 | — | — | US | disclosed |
| EP-0011858-A1 | Radioiodine containing amines, their preparation and their use as brain imaging agents | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1980-06-11 | — | — | EP | disclosed |