Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL29955172 | 0.85 | TDP1 (0.41) | ALDH1A1HPGDTSHRTDP1MEN1 | |
| SCHEMBL1169909 | 0.85 | TDP1 (0.41) | ALDH1A1TP53GAAPOLBKDM4E | |
| SCHEMBL29954725 | 0.83 | ICMT (0.35) | ALDH1A1 | |
| SCHEMBL3362751 | 0.81 | TDP1 (0.40) | ALDH1A1TP53GAAHPGDTSHR | |
| SCHEMBL2832222 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TP53CNR2TSHRTDP1 | |
| SCHEMBL9104204 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TP53CNR2TSHRTDP1 | |
| SCHEMBL9746113 | 0.79 | ALDH1A1 (0.41) | ALDH1A1TP53CNR2TSHRTDP1 | |
| SCHEMBL29957441 | 0.79 | ALDH1A1 (0.39) | ALDH1A1TP53HPGDCYP1A2TSHR | |
| SCHEMBL2559629 | 0.79 | AOC3 (0.36) | ALDH1A1POLBTSHRTDP1MEN1 | |
| SCHEMBL2557425 | 0.77 | MEN1 (0.40) | ALDH1A1TP53GAAPOLBKDM4E |
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 |