Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 5/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | GMNN | O75496 | 1/20 | 0.30 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Isopropyl Alcohol SCHEMBL28432132 | 0.91 | ALDH1A1 (0.35) | ALDH1A1LMNATDP1TSHRMAPK1 | |
| SCHEMBL9292760 | 0.90 | TDP1 (0.39) | ALDH1A1LMNATDP1TSHRMAPK1 | |
| Propylene Glycol SCHEMBL11271849 | 0.87 | TDP1 (0.62) | ALDH1A1LMNATDP1TSHRMAPK1 | |
| Propylene Glycol SCHEMBL5699521 | 0.87 | TDP1 (0.62) | ALDH1A1LMNATDP1TSHRMAPK1 | |
| SCHEMBL19621 | 0.84 | — | — | |
| SCHEMBL229715 | 0.84 | ALDH1A1 (0.35) | ALDH1A1LMNATSHRMAPK1MEN1 | |
| SCHEMBL10942109 | 0.83 | TSHR (0.38) | TDP1TSHR | |
| Bromide SCHEMBL8990185 | 0.81 | — | — | |
| Bromide SCHEMBL8990184 | 0.81 | ALDH1A1 (0.33) | ALDH1A1LMNATSHRMAPK1MEN1 | |
| SCHEMBL7650639 | 0.81 | ALDH1A1 (0.33) | ALDH1A1LMNATSHRMAPK1MEN1 |
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-109082280-A | A kind of preparation method of liquid crystal material | 宁夏中星显示材料有限公司 | 2018-12-25 | — | — | CN | disclosed |