Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | SHBG | P04278 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MDH1 | P40925 | 7/20 | 0.35 |
| ▸ | MDH2 | P40926 | 7/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | APAF1 | O14727 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | FYN | P06241 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22773184 | 0.85 | CYP3A4 (0.58) | SMN1; SMN2CYP3A4SHBGMAPTNPC1 | |
| Butylamine SCHEMBL27461778 | 0.80 | SHBG (0.70) | SMN1; SMN2CYP3A4SHBGHIF1ATSHR | |
| Butylamine SCHEMBL7759176 | 0.80 | SHBG (0.70) | SMN1; SMN2CYP3A4SHBGHIF1ATSHR | |
| Butylamine SCHEMBL28296259 | 0.78 | SHBG (0.68) | SMN1; SMN2CYP3A4SHBGHIF1ATSHR | |
| Butylamine SCHEMBL6904543 | 0.78 | SHBG (0.44) | SMN1; SMN2CYP3A4SHBGKIF11HIF1A | |
| Butylamine SCHEMBL27780646 | 0.78 | SHBG (0.68) | SMN1; SMN2CYP3A4SHBGHIF1ATSHR | |
| SCHEMBL28472883 | 0.75 | CYP3A4 (0.54) | SMN1; SMN2CYP3A4SHBGMAPTNPC1 | |
| SCHEMBL28747587 | 0.74 | CYP3A4 (0.61) | SMN1; SMN2CYP3A4SHBGMAPTNPC1 | |
| SCHEMBL10513790 | 0.73 | CYP3A4 (0.66) | SMN1; SMN2CYP3A4TSHRTP53HRH3 | |
| SCHEMBL480668 | 0.70 | CYP3A4 (0.61) | SMN1; SMN2CYP3A4SHBGMAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113651957-A | Black-spot-free polyamide composition and polymerization process thereof | 上海恒什塑料技术有限公司 | 2021-11-16 | — | — | CN | disclosed |