Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
| ▸ | APEX1 | P27695 | 1/20 | 0.66 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.66 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.63 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.63 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.63 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.60 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Iofetamine SCHEMBL1534301 | 0.81 | CYP1A2 (1.00) | CYP2D6CYP1A2APEX1PMP22SIGMAR1 | |
| Iofetamine SCHEMBL3064259 | 0.81 | CYP1A2 (1.00) | CYP2D6CYP1A2APEX1PMP22SIGMAR1 | |
| Iofetamine SCHEMBL11151697 | 0.81 | CYP1A2 (1.00) | CYP2D6CYP1A2APEX1PMP22SIGMAR1 | |
| SCHEMBL178625 | 0.80 | TAAR1 (0.65) | CYP2D6SIGMAR1TAAR1SLC18A2SLC6A4 | |
| SCHEMBL10076448 | 0.80 | TAAR1 (0.65) | CYP2D6SIGMAR1TAAR1SLC18A2SLC6A4 | |
| SCHEMBL765297 | 0.80 | TAAR1 (0.65) | CYP2D6SIGMAR1TAAR1SLC18A2SLC6A4 | |
| Iofetamine SCHEMBL7755724 | 0.79 | APEX1 (1.00) | CYP2D6CYP1A2APEX1PMP22SIGMAR1 | |
| SCHEMBL22249109 | 0.79 | SIGMAR1 (0.66) | CYP2D6CYP1A2APEX1PMP22SIGMAR1 | |
| Iofetamine SCHEMBL8973644 | 0.79 | APEX1 (1.00) | CYP2D6CYP1A2APEX1PMP22SIGMAR1 | |
| Hydrochloric Acid SCHEMBL23524368 | 0.78 | TAAR1 (0.63) | CYP2D6SIGMAR1TAAR1SLC18A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4360511-A | Amines useful as brain imaging agents | MEDI-PHYSICS, INC. (US) | 1982-11-23 | — | — | US | disclosed |