Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26971012 | 0.83 | TDP1 (0.42) | TDP1ERN1ALDH1A1CYP11B2CYP1A2 | |
| SCHEMBL31573311 | 0.83 | TDP1 (0.42) | TDP1ERN1ALDH1A1CYP11B2CYP1A2 | |
| SCHEMBL23457229 | 0.79 | CYP11B2 (0.31) | CYP11B2 | |
| SCHEMBL1533918 | 0.78 | TDP1 (0.40) | TDP1ERN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL24086588 | 0.78 | ERN1 (0.38) | ERN1 | |
| SCHEMBL30589401 | 0.78 | TDP1 (0.40) | TDP1ERN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL24086660 | 0.75 | GRIA1 (0.37) | ERN1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL15012943 | 0.75 | TDP1 (0.38) | TDP1ERN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL660973 | 0.75 | TDP1 (0.38) | TDP1ERN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL31723867 | 0.75 | TDP1 (0.38) | TDP1ERN1ALDH1A1CYP1A2CYP3A4 |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |