Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 6/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27580489 | 0.77 | TSHR (0.42) | HCAR2TSHRHPGDALDH1A1TP53 | |
| SCHEMBL941853 | 0.76 | ALDH1A1 (0.41) | TSHRHPGDALDH1A1TP53HIF1A | |
| SCHEMBL263812 | 0.75 | — | — | |
| Acrylic Acid Methyl Ester SCHEMBL6932742 | 0.75 | HCAR2 (0.48) | HCAR2KEAP1NFE2L2TSHRHPGD | |
| SCHEMBL27747498 | 0.74 | TSHR (0.39) | TSHRHPGDALDH1A1TP53HIF1A | |
| Acrylic Acid Methyl Ester SCHEMBL27465044 | 0.73 | HCAR2 (0.46) | HCAR2KEAP1NFE2L2TSHRHPGD | |
| Hydrochloric Acid SCHEMBL18316478 | 0.73 | — | — | |
| Acrylic Acid Methyl Ester SCHEMBL7643475 | 0.73 | HCAR2 (0.46) | HCAR2KEAP1NFE2L2TSHRHPGD | |
| SCHEMBL3889078 | 0.73 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL28193082 | 0.73 | TSHR (0.34) | TSHRHPGDALDH1A1TP53HIF1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113174020-B | Preparation of high-performance low-shrinkage hyperbranched polyamine-ester composite resin for dental repair | 东华大学 | 2022-08-16 | — | — | CN | disclosed |
| CN-114478912-A | Light-cured retention material and application thereof | 上海新世纪齿科材料有限公司 | 2022-05-13 | — | — | CN | disclosed |
| CN-113174020-A | Preparation of high-performance low-shrinkage hyperbranched polyamine-ester composite resin for dental repair | 东华大学 | 2021-07-27 | — | — | CN | disclosed |