Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL10049414 | 0.87 | CYP2D6 (0.56) | CYP2D6TSHRKDM4E | |
| SCHEMBL12516820 | 0.80 | CYP2D6 (0.43) | CYP2D6TSHRKDM4E | |
| SCHEMBL10049405 | 0.79 | CYP2D6 (0.47) | CYP2D6TSHRKDM4E | |
| SCHEMBL24774250 | 0.77 | CYP2D6 (0.45) | CYP2D6KDM4E | |
| SCHEMBL21901449 | 0.77 | CYP2D6 (0.45) | CYP2D6KDM4E | |
| SCHEMBL14186781 | 0.75 | CYP2D6 (0.43) | CYP2D6KDM4E | |
| SCHEMBL15305205 | 0.74 | — | — | |
| SCHEMBL21236621 | 0.73 | ALDH1A1 (0.37) | ALDH1A1TSHRTDP1 | |
| SCHEMBL1369618 | 0.73 | — | — | |
| SCHEMBL14037579 | 0.72 | ALDH1A1 (0.39) | CYP2D6ALDH1A1TSHRTDP1 |
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-3298066-B1 | DENDRI-TAC AND THEIR USE AS THERANOSTICS | UNIV D'AVIGNON ET DES PAYS DE VAUCLUSE (FR) | 2019-08-07 | — | — | EP | disclosed |