Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CTH | P32929 | 1/20 | 0.35 |
| ▸ | CBS | P35520 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 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 | |
|---|---|---|---|---|
| SCHEMBL31232411 | 0.92 | ALDH1A1 (0.36) | ALDH1A1TSHRCTHCBSTHPO | |
| SCHEMBL2164482 | 0.87 | — | — | |
| SCHEMBL157312 | 0.85 | — | — | |
| SCHEMBL2162999 | 0.84 | ALDH1A1 (0.40) | ALDH1A1TSHRCTHCBSTHPO | |
| SCHEMBL1827088 | 0.83 | TSHR (0.36) | ALDH1A1TSHRCTHCBSTHPO | |
| SCHEMBL26620817 | 0.83 | TSHR (0.36) | ALDH1A1TSHRCTHCBSTHPO | |
| Acetic Acid SCHEMBL11149412 | 0.83 | TSHR (0.36) | ALDH1A1TSHRCTHCBSTHPO | |
| SCHEMBL6534540 | 0.83 | ALDH1A1 (0.43) | ALDH1A1TSHRCTHCBSTHPO | |
| SCHEMBL3791284 | 0.83 | ALDH1A1 (0.43) | ALDH1A1TSHRCTHCBSTHPO | |
| SCHEMBL21876707 | 0.83 | ALDH1A1 (0.43) | ALDH1A1TSHRCTHCBSTHPO |
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-0474008-A1 | Amino acid derivatives | MERCK PATENT GmbH (DE) | 1992-03-11 | — | — | EP | disclosed |