Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | TACR2 | P21452 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | XBP1 | P17861 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29957827 | 0.89 | ALDH1A1 (0.67) | ALDH1A1KDM4ESMN1; SMN2POLBHTT | |
| SCHEMBL29953109 | 0.89 | ALDH1A1 (0.75) | ALDH1A1KDM4ESMN1; SMN2POLBMAPT | |
| SCHEMBL15331054 | 0.88 | ALDH1A1 (0.67) | ALDH1A1KDM4ESMN1; SMN2POLBTACR2 | |
| SCHEMBL2551892 | 0.87 | ALDH1A1 (0.81) | ALDH1A1KDM4ESMN1; SMN2POLBTACR2 | |
| SCHEMBL15329731 | 0.85 | ALDH1A1 (0.70) | ALDH1A1KDM4ESMN1; SMN2POLBTACR2 | |
| SCHEMBL2558600 | 0.84 | ALDH1A1 (0.54) | ALDH1A1KDM4ESMN1; SMN2POLBGAA | |
| SCHEMBL15331959 | 0.84 | ALDH1A1 (0.54) | ALDH1A1KDM4ESMN1; SMN2POLBHPGD | |
| SCHEMBL2557291 | 0.83 | ALDH1A1 (0.78) | ALDH1A1KDM4ESMN1; SMN2POLBTACR2 | |
| SCHEMBL2556722 | 0.83 | ALDH1A1 (0.67) | ALDH1A1KDM4ESMN1; SMN2POLBTACR2 | |
| SCHEMBL2562592 | 0.81 | ALDH1A1 (0.76) | ALDH1A1KDM4ESMN1; SMN2POLBTACR2 |
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 |