Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL66260 | 0.82 | LCK (0.46) | LCKDRD3CASP1ALDH1A1TSHR | |
| SCHEMBL10017660 | 0.82 | ALDH1A1 (0.45) | ALDH1A1TSHR | |
| SCHEMBL29954670 | 0.82 | LCK (0.36) | LCKDRD3CASP1TSHR | |
| SCHEMBL5167080 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TSHR | |
| SCHEMBL17970396 | 0.80 | LCK (0.35) | LCKDRD3CASP1TSHR | |
| SCHEMBL11687703 | 0.78 | TSHR (0.43) | LCKDRD3CASP1ALDH1A1TSHR | |
| SCHEMBL64558 | 0.78 | — | — | |
| SCHEMBL445535 | 0.78 | — | — | |
| SCHEMBL1283318 | 0.75 | ALDH1A1 (0.43) | ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL10492840 | 0.75 | LCK (0.44) | LCKDRD3CASP1ALDH1A1TSHR |
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 |