Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | APP | P05067 | 12/20 | 0.48 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL508682 | 0.86 | CYP3A4 (0.64) | CYP3A4IDO1APPHRH4HRH3 | |
| SCHEMBL492258 | 0.86 | TSHR (0.52) | CYP3A4TSHRLOXL2 | |
| Hydrochloric Acid SCHEMBL27794104 | 0.84 | TSHR (0.50) | CYP3A4TSHRLOXL2 | |
| SCHEMBL3541962 | 0.79 | HDAC8 (0.57) | CYP3A4HDAC8TSHRLOXL2 | |
| SCHEMBL1825953 | 0.79 | APP (0.73) | HDAC8APP | |
| SCHEMBL20004502 | 0.78 | KCNH2 (0.52) | CYP3A4IDO1TSHRLOXL2 | |
| SCHEMBL14156900 | 0.78 | IDO1 (0.50) | IDO1 | |
| SCHEMBL22537715 | 0.78 | RAB9A (0.46) | CYP3A4TSHRLOXL2 | |
| SCHEMBL14156909 | 0.78 | IDO1 (0.50) | CYP3A4IDO1APP | |
| SCHEMBL3500426 | 0.77 | TSHR (0.71) | CYP3A4IDO1APPTSHR |
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-2018055316-A1 | COMPOUNDS FOR USING IN IMAGING AND PARTICULARLY FOR THE DIAGNOSIS OF NEURODEGENERATIVE DISEASES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2018-03-29 | — | — | WO | disclosed |