Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | NQO2 | P16083 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | DAO | P14920 | 1/20 | 0.44 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6579896 | 0.78 | ALDH1A1 (0.61) | ALDH1A1NQO2KDM4EMEN1POLB | |
| SCHEMBL6576708 | 0.77 | ALDH1A1 (0.56) | ALDH1A1NQO2KDM4EMEN1POLB | |
| SCHEMBL7811009 | 0.74 | ALDH1A1 (0.56) | ALDH1A1NQO2KDM4EMEN1POLB | |
| SCHEMBL7816985 | 0.71 | ALDH1A1 (0.53) | ALDH1A1NQO2KDM4EMEN1POLB | |
| SCHEMBL6402848 | 0.71 | HPGD (0.57) | ALDH1A1NQO2KDM4EMEN1POLB | |
| SCHEMBL3423322 | 0.70 | NQO2 (0.57) | ALDH1A1NQO2KDM4EMEN1POLB | |
| SCHEMBL28325027 | 0.70 | KDM4E (0.62) | ALDH1A1NQO2KDM4EMEN1POLB | |
| SCHEMBL203282 | 0.68 | ENPP2 (0.60) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL20605619 | 0.68 | GAA (0.62) | ALDH1A1NQO2KDM4EMEN1POLB | |
| SCHEMBL5433980 | 0.68 | NQO2 (1.00) | ALDH1A1NQO2KDM4EMEN1POLB |
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 |