Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.68 |
| ▸ | TSHR | P16473 | 6/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | SCN1A | P35498 | 2/20 | 0.45 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.45 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27666844 | 0.91 | CYP3A4 (0.64) | CYP3A4TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL3859566 | 0.90 | CYP3A4 (0.62) | CYP3A4TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL9421944 | 0.89 | CYP3A4 (0.74) | CYP3A4TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL28248052 | 0.83 | TSHR (0.55) | CYP3A4TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL15485816 | 0.83 | CYP3A4 (0.74) | CYP3A4TSHRALDH1A1HSD17B10L3MBTL1 | |
| SCHEMBL7878156 | 0.83 | CYP3A4 (0.74) | CYP3A4TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL851234 | 0.83 | CYP3A4 (0.74) | CYP3A4TSHRALDH1A1HSD17B10LMNA | |
| SCHEMBL8733285 | 0.82 | TSHR (0.69) | CYP3A4TSHRALDH1A1HSD17B10TDP1 | |
| Ethane SCHEMBL28085459 | 0.82 | CYP3A4 (0.92) | CYP3A4TSHRALDH1A1HSD17B10TDP1 | |
| SCHEMBL16371573 | 0.82 | CYP3A4 (1.00) | CYP3A4TSHRALDH1A1HSD17B10TDP1 |
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-1843228-A | Composite food preservatives | SHI ZHONGXIN (CN) | 2006-10-11 | — | — | CN | claimed |
| CN-1843228-A | Composite food preservatives | SHI ZHONGXIN (CN) | 2006-10-11 | — | — | CN | disclosed |