Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | AGER | Q15109 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 3/20 | 0.33 |
| ▸ | SLC6A5 | Q9Y345 | 2/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.33 |
| ▸ | ITK | Q08881 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29954068 | 0.82 | LMNA (0.38) | ALDH1A1LMNAMAPTMAPK1PTGDR2 | |
| SCHEMBL29952749 | 0.81 | ALDH1A1 (0.37) | JAK2ALDH1A1LMNAMAPTMAPK1 | |
| SCHEMBL29956039 | 0.79 | ERN1 (0.40) | ALDH1A1MAPTERN1DPP9 | |
| SCHEMBL2563489 | 0.77 | ERN1 (0.39) | ALDH1A1MAPTERN1 | |
| SCHEMBL29952265 | 0.75 | ALDH1A1 (0.37) | ALDH1A1LMNAMAPK1 | |
| SCHEMBL2556059 | 0.73 | ERN1 (0.35) | ALDH1A1MAPTERN1DPP4DPP9 | |
| SCHEMBL29955001 | 0.73 | S1PR1 (0.39) | ALDH1A1LMNAMAPK1 | |
| SCHEMBL2560168 | 0.71 | IDO1 (0.36) | ALDH1A1MAPTIDO1ERN1 | |
| SCHEMBL7833629 | 0.71 | NOS2 (0.39) | — | |
| SCHEMBL29952124 | 0.71 | ALDH1A1 (0.39) | ALDH1A1MAPK1 |
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 |