Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL29956312 | 0.78 | HRH3 (0.37) | ALDH1A1KDM4E | |
| SCHEMBL29957200 | 0.75 | CHRM2 (0.44) | ALDH1A1POLBKDM4EHSD17B10 | |
| SCHEMBL29952026 | 0.74 | KCNH2 (0.48) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL29954552 | 0.74 | OPRD1 (0.40) | MEN1KMT2ACA12CA1CA2 | |
| SCHEMBL14878189 | 0.73 | ALDH1A1 (0.46) | ALDH1A1MEN1KMT2AHSP90AA1NPC1 | |
| SCHEMBL11681136 | 0.73 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2AHSP90AA1NPC1 | |
| SCHEMBL11682805 | 0.72 | ALDH1A1 (0.40) | ALDH1A1MEN1KMT2AHSP90AA1NPC1 | |
| SCHEMBL29950879 | 0.71 | KCNH2 (0.51) | MEN1KMT2AGAA | |
| SCHEMBL29952297 | 0.71 | RECQL (0.34) | ALDH1A1ACHECA12CA1CA2 | |
| SCHEMBL29956333 | 0.69 | OPRM1 (0.40) | ALDH1A1USP2 |
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 |