Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN1A | P35498 | 4/20 | 0.72 |
| ▸ | SCN2A | Q99250 | 4/20 | 0.72 |
| ▸ | SCN3A | Q9NY46 | 4/20 | 0.72 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.57 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.57 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.55 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | MAOA | P21397 | 2/20 | 0.54 |
| ▸ | HTR3A | P46098 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL22318656 | 0.86 | SCN1A (0.58) | SCN1ASCN2ASCN3ALMNACHRM2 | |
| Detanosal SCHEMBL2110875 | 0.84 | SCN1A (0.68) | SCN1ASCN2ASCN3ACYP2D6LMNA | |
| SCHEMBL11677653 | 0.84 | ALDH1A1 (0.56) | SCN1ASCN2ASCN3ALMNACHRM1 | |
| Aspirin Trelamine SCHEMBL2472615 | 0.84 | SCN1A (0.63) | SCN1ASCN2ASCN3ACYP2D6LMNA | |
| Aspirin Trelamine SCHEMBL29481379 | 0.84 | SCN1A (0.63) | SCN1ASCN2ASCN3ACYP2D6LMNA | |
| Detanosal SCHEMBL27797753 | 0.84 | SCN1A (0.67) | SCN1ASCN2ASCN3ACYP2D6LMNA | |
| SCHEMBL3813394 | 0.83 | SCN1A (0.66) | SCN1ASCN2ASCN3ACYP2D6LMNA | |
| Detanosal SCHEMBL29163805 | 0.83 | SCN1A (0.66) | SCN1ASCN2ASCN3ACYP2D6LMNA | |
| SCHEMBL21705597 | 0.83 | SCN1A (0.66) | SCN1ASCN2ASCN3ACYP2D6LMNA | |
| SCHEMBL4644788 | 0.83 | SCN1A (0.66) | SCN1ASCN2ASCN3ACYP2D6LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106008238-A | Plant growth regulator bis-diethylaminoethanol phthalate citrate compound and preparation method thereof | 苏州科技学院 | 2016-10-12 | — | — | CN | claimed |
| CN-106008238-A | Plant growth regulator bis-diethylaminoethanol phthalate citrate compound and preparation method thereof | 苏州科技学院 | 2016-10-12 | — | — | CN | disclosed |