Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28653906 | 0.86 | TSHR (0.44) | TSHRHDAC1LMNATYRALDH1A1 | |
| SCHEMBL14339302 | 0.80 | TSHR (0.48) | TSHRHDAC1LMNATYRALDH1A1 | |
| SCHEMBL3129845 | 0.80 | TSHR (0.48) | TSHRHDAC1LMNATYRALDH1A1 | |
| SCHEMBL16302778 | 0.78 | TSHR (0.46) | TSHRHDAC1LMNATYRALDH1A1 | |
| SCHEMBL28650186 | 0.78 | CES2 (0.44) | TSHRALDH1A1NPC1RAB9ASRD5A2 | |
| SCHEMBL11319555 | 0.76 | TSHR (0.44) | TSHRHDAC1LMNATYRALDH1A1 | |
| SCHEMBL4320814 | 0.76 | LMNA (0.56) | TSHRHDAC1LMNATYRALDH1A1 | |
| SCHEMBL665714 | 0.76 | HDAC1 (0.48) | TSHRHDAC1LMNATYRALDH1A1 | |
| SCHEMBL4373215 | 0.74 | HDAC1 (0.47) | TSHRHDAC1LMNATYRALDH1A1 | |
| SCHEMBL4319883 | 0.74 | ALDH1A1 (0.43) | TSHRHDAC1LMNATYRALDH1A1 |
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-113583042-B | Preparation method of phosphoryl fluoride compound | 烟台大学 | 2023-08-29 | — | — | CN | disclosed |
| CN-112174761-B | Fluorination method | 三明市海斯福化工有限责任公司 | 2023-03-24 | — | — | CN | disclosed |
| CN-113583042-A | Preparation method of phosphoryl fluoride compound | 烟台大学 | 2021-11-02 | — | — | CN | disclosed |