Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | SCN1A | P35498 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 3/20 | 0.42 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL58021 | 0.85 | CES1 (0.55) | LMNAL3MBTL1CYP2D6TDP1CES1 | |
| Dimethylamine SCHEMBL6328605 | 0.83 | CES1 (0.50) | CYP2D6TDP1CES1SRCALDH1A1 | |
| SCHEMBL6202040 | 0.81 | LMNA (0.48) | LMNAHTTL3MBTL1HTR1ACYP2D6 | |
| Ether SCHEMBL5570218 | 0.81 | CES1 (0.49) | LMNAL3MBTL1TDP1CES1SRC | |
| Methoxymethane SCHEMBL7788767 | 0.80 | CES1 (0.59) | L3MBTL1CYP2D6TDP1CES1SRC | |
| SCHEMBL11661275 | 0.80 | CES1 (0.50) | L3MBTL1CYP2D6TDP1CES1SRC | |
| SCHEMBL6322487 | 0.78 | CES1 (0.45) | LMNACYP2D6CES1SRCALDH1A1 | |
| Benzoic Acid SCHEMBL4086034 | 0.76 | TSHR (0.58) | LMNAHTR1ACYP2D6SCN1ASLC6A3 | |
| SCHEMBL6188978 | 0.76 | LMNA (0.55) | LMNAHTTL3MBTL1HTR1ACYP2D6 | |
| Diphenylether SCHEMBL11868938 | 0.76 | CES1 (0.50) | LMNAL3MBTL1TDP1CES1SRC |
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-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |