Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | NAMPT | P43490 | 2/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | FPR2 | P25090 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7662633 | 0.87 | MEN1 (0.43) | ALDH1A1CYP2C9MAPTGAACHRNB2 | |
| SCHEMBL7666580 | 0.85 | ALDH1A1 (0.39) | ALDH1A1CYP2C9FAAHMAPTCHRNB2 | |
| SCHEMBL8404155 | 0.84 | ALDH1A1 (0.43) | ALDH1A1CYP2C9NAMPTFAAHMAPT | |
| SCHEMBL10440329 | 0.81 | EGLN1 (0.41) | CYP2C9GAAL3MBTL1CYP2C19 | |
| SCHEMBL9047024 | 0.78 | FPR2 (0.44) | ALDH1A1CYP2C9NAMPTFAAHMAPT | |
| SCHEMBL9047032 | 0.78 | FPR2 (0.44) | ALDH1A1CYP2C9NAMPTFAAHMAPT | |
| SCHEMBL13068901 | 0.78 | CYP2C9 (0.44) | ALDH1A1CYP2C9NAMPTFAAHMAPT | |
| SCHEMBL7641149 | 0.77 | CHRNB2 (0.44) | ALDH1A1CYP2C9NAMPTFAAHMAPT | |
| SCHEMBL7641148 | 0.77 | CHRNB2 (0.44) | ALDH1A1CYP2C9NAMPTFAAHMAPT | |
| SCHEMBL9595189 | 0.76 | ALDH1A1 (0.41) | ALDH1A1CYP2C9MAPTKDM4EGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-6407248-B1 | INSECTICIDES, MITICIDES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-06-18 | — | — | US | disclosed |
| EP-0302389-A2 | Alpha-unsaturated amines, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1989-02-08 | — | — | EP | disclosed |