Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BLM | P54132 | 2/20 | 0.56 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.56 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | LDHB | P07195 | 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL9001173 | 0.86 | NPSR1 (0.62) | BLMPMP22CYP2C19NPSR1THRB | |
| Carbamic Acid SCHEMBL8559482 | 0.83 | — | — | |
| Acetone SCHEMBL28483119 | 0.82 | TSHR (0.67) | BLMPMP22CYP2C19NPSR1THRB | |
| SCHEMBL31167 | 0.80 | — | — | |
| SCHEMBL3983773 | 0.80 | — | — | |
| SCHEMBL7091698 | 0.80 | — | — | |
| Butanedione SCHEMBL1424734 | 0.79 | TSHR (0.73) | BLMPMP22CYP2C19NPSR1THRB | |
| SCHEMBL97805 | 0.78 | — | — | |
| SCHEMBL97807 | 0.78 | — | — | |
| SCHEMBL97806 | 0.78 | — | — |
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-115487352-A | Degradable hydroxamate bionic vascular network based on metal ion coordination | 东华大学 | 2022-12-20 | — | — | CN | disclosed |
| CN-110066414-B | Multifunctional multiple protection material and preparation method thereof | 东华大学 | 2021-09-21 | — | — | CN | disclosed |
| CN-110066414-B | Multifunctional multiple protection material and preparation method thereof | 东华大学 | 2021-09-21 | — | — | CN | disclosed |