Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.38 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MMP12 | P39900 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.37 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.37 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2292807 | 0.86 | HCAR2 (0.59) | HCAR2ALDH1A1CYP3A4HSD17B10TP53 | |
| SCHEMBL114793 | 0.86 | HCAR2 (0.59) | HCAR2ALDH1A1CYP3A4HSD17B10TP53 | |
| SCHEMBL6267290 | 0.86 | HCAR2 (0.59) | HCAR2ALDH1A1CYP3A4HSD17B10TP53 | |
| SCHEMBL6392245 | 0.86 | HCAR2 (0.59) | HCAR2ALDH1A1CYP3A4HSD17B10TP53 | |
| Hydrochloric Acid SCHEMBL27545522 | 0.84 | HCAR2 (0.58) | HCAR2ALDH1A1CYP3A4HSD17B10TP53 | |
| Phenyl Ethanol SCHEMBL26680185 | 0.83 | HPGD (0.43) | HCAR2ALDH1A1CYP3A4HPGDCYP2C19 | |
| SCHEMBL27420787 | 0.82 | PTGS2 (0.51) | ALDH1A1CYP3A4HSD17B10HPGDTSHR | |
| Alcohol SCHEMBL4648871 | 0.80 | HCAR2 (0.53) | HCAR2ALDH1A1CYP3A4LTB4RLTB4R2 | |
| Ethylene Glycol SCHEMBL2515273 | 0.80 | HCAR2 (0.53) | HCAR2ALDH1A1CYP3A4LTB4RLTB4R2 | |
| Phenyl Ethanol SCHEMBL28893774 | 0.80 | HCAR2 (0.53) | HCAR2ALDH1A1CYP3A4HSD17B10TP53 |
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-105175605-B | Polystyrene vinyl acetate and preparation method and application thereof | 中国石油天然气股份有限公司 | 2017-11-10 | — | — | CN | disclosed |