Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | NAAA | Q02083 | 2/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.34 |
| ▸ | PRKCA | P17252 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 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 | |
|---|---|---|---|---|
| Acrylic Acid Ethyl Ester SCHEMBL28358086 | 0.87 | TSHR (0.36) | TSHRHPGDALDH1A1CYP3A4HCAR2 | |
| SCHEMBL4368658 | 0.79 | TSHR (0.79) | TSHRHPGDALDH1A1CYP3A4ATM | |
| SCHEMBL15037 | 0.75 | — | — | |
| SCHEMBL11582291 | 0.75 | TSHR (1.00) | TSHRHPGDALDH1A1CYP3A4ATM | |
| SCHEMBL1330627 | 0.75 | — | — | |
| SCHEMBL5681395 | 0.75 | TSHR (1.00) | TSHRHPGDALDH1A1CYP3A4ATM | |
| SCHEMBL1331857 | 0.75 | — | — | |
| SCHEMBL27678011 | 0.74 | TSHR (0.76) | TSHRHPGDALDH1A1CYP3A4ATM | |
| SCHEMBL1160870 | 0.73 | TSHR (0.96) | TSHRHPGDALDH1A1CYP3A4ATM | |
| SCHEMBL11582281 | 0.73 | TSHR (0.96) | TSHRHPGDALDH1A1CYP3A4ATM |
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-110746354-B | Acrylate compound, preparation method and application | 山东瑞博龙化工科技股份有限公司 | 2021-02-26 | — | — | CN | disclosed |
| CN-110746354-A | Acrylate compound, preparation method and application | 山东瑞博龙化工科技股份有限公司 | 2020-02-04 | — | — | CN | disclosed |