Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Allylbenzene SCHEMBL709296 | 0.92 | CYP3A4 (0.43) | ALDH1A1TSHRMEN1KMT2ACYP3A4 | |
| Styrene SCHEMBL315930 | 0.86 | ALDH1A1 (0.61) | ALDH1A1TSHRCYP3A4TDP1TP53 | |
| Allylbenzene SCHEMBL757639 | 0.84 | ALDH1A1 (0.64) | ALDH1A1TSHRMEN1KMT2ACYP3A4 | |
| Styrene SCHEMBL2941460 | 0.83 | ALDH1A1 (0.56) | ALDH1A1TSHRCYP3A4TDP1TP53 | |
| Allylbenzene SCHEMBL28284002 | 0.82 | ALDH1A1 (0.61) | ALDH1A1TSHRMEN1KMT2ACYP3A4 | |
| Styrene SCHEMBL27448638 | 0.81 | ALDH1A1 (0.42) | ALDH1A1TSHRMEN1KMT2ACYP3A4 | |
| Styrene SCHEMBL27519908 | 0.81 | ALDH1A1 (0.54) | ALDH1A1TSHRCYP3A4TDP1TP53 | |
| Allylbenzene SCHEMBL9774331 | 0.81 | ALDH1A1 (0.50) | ALDH1A1TSHRMEN1KMT2ACYP3A4 | |
| Allylbenzene SCHEMBL27584746 | 0.80 | ALDH1A1 (0.56) | ALDH1A1TSHRMEN1KMT2ACYP3A4 | |
| Allylbenzene SCHEMBL1637296 | 0.80 | CNR2 (0.52) | ALDH1A1TSHRMEN1KMT2ACYP3A4 |
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-103025846-B | Elastomer-modified cross-linked epoxy vinyl esters granule and their preparation and application | 3M创新有限公司 | 2016-07-06 | — | — | CN | disclosed |