Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | PPARD | Q03181 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| (Chloromethyl)Benzene SCHEMBL29242171 | 0.91 | ALDH1A1 (0.54) | ALDH1A1TSHRCA1CA2TP53 | |
| Allylbenzene SCHEMBL27584746 | 0.89 | ALDH1A1 (0.56) | ALDH1A1TSHRCA1CA2CYP3A4 | |
| Allylbenzene SCHEMBL27688145 | 0.89 | MAOB (0.48) | ALDH1A1TSHRCA1CA2CYP3A4 | |
| Styrene SCHEMBL2831366 | 0.87 | ALDH1A1 (0.61) | ALDH1A1TSHRCA1CA2TP53 | |
| Styrene SCHEMBL27972794 | 0.87 | ALDH1A1 (0.61) | ALDH1A1TSHRCA1CA2TP53 | |
| Styrene SCHEMBL28222001 | 0.85 | ALDH1A1 (0.64) | ALDH1A1TSHRCA1CA2CYP3A4 | |
| Allylbenzene SCHEMBL757639 | 0.85 | ALDH1A1 (0.64) | ALDH1A1TSHRCA1CA2CYP3A4 | |
| Styrene SCHEMBL27547935 | 0.85 | ALDH1A1 (0.64) | ALDH1A1TSHRCA1CA2CYP3A4 | |
| Allylbenzene SCHEMBL28279624 | 0.83 | ALDH1A1 (0.56) | ALDH1A1TSHRCA1CA2CYP3A4 | |
| Allylbenzene SCHEMBL28284002 | 0.83 | ALDH1A1 (0.61) | ALDH1A1TSHRCA1CA2CYP3A4 |
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-104829765-A | Microporous ionized resin with high oil absorption performance and preparation method thereof | UNIV TIANJIN | 2015-08-12 | — | — | CN | disclosed |