Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.44 |
| ▸ | GAA | P10253 | 6/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | MAT2A | P31153 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29951199 | 0.85 | ALDH1A1 (0.46) | ALDH1A1GAAKDM4ELMNASMN1; SMN2 | |
| SCHEMBL21352398 | 0.82 | ALDH1A1 (0.40) | ALDH1A1KDM4ESMN1; SMN2HPGDHTT | |
| SCHEMBL16764607 | 0.76 | ALDH1A1 (0.67) | ALDH1A1GAAKDM4ELMNASMN1; SMN2 | |
| SCHEMBL2561856 | 0.74 | OPRM1 (0.41) | ALDH1A1GAAKDM4EMAT2ALMNA | |
| SCHEMBL2554624 | 0.72 | ALDH1A1 (0.35) | ALDH1A1GAAKDM4EMAT2ASMN1; SMN2 | |
| SCHEMBL15330545 | 0.69 | ALDH1A1 (0.44) | ALDH1A1GAAKDM4EMAT2ALMNA | |
| SCHEMBL29956526 | 0.69 | ERN1 (0.38) | ALDH1A1GAAKDM4ELMNASMN1; SMN2 | |
| SCHEMBL14045270 | 0.68 | OPRM1 (0.50) | ALDH1A1MAT2ALMNASMN1; SMN2HTT | |
| SCHEMBL2557844 | 0.68 | ERN1 (0.37) | ALDH1A1KDM4ELMNASMN1; SMN2HTT | |
| SCHEMBL715554 | 0.66 | ALDH1A1 (0.58) | ALDH1A1GAAKDM4ELMNASMN1; SMN2 |
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 |