Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 6/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 2/20 | 0.43 |
| ▸ | BPTF | Q12830 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.39 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL813450 | 0.87 | PARP1 (0.53) | CYP3A4SMN1; SMN2PARP1TSHRPOLB | |
| Terephthalamide SCHEMBL27383156 | 0.82 | PARP1 (0.57) | CYP3A4PARP1TSHRPOLBMAPT | |
| SCHEMBL4447450 | 0.81 | PRSS1 (0.42) | CYP3A4SMN1; SMN2PARP1TSHRPOLB | |
| SCHEMBL8579498 | 0.78 | PLA2G10 (0.50) | CYP3A4SMN1; SMN2PARP1TSHRPOLB | |
| SCHEMBL8579492 | 0.78 | CYP3A4 (0.41) | CYP3A4SMN1; SMN2PARP1TSHRPOLB | |
| SCHEMBL1498158 | 0.77 | DHODH (0.65) | CYP3A4SMN1; SMN2PARP1TSHRPOLB | |
| SCHEMBL31601062 | 0.77 | DHODH (0.48) | CYP3A4SMN1; SMN2PARP1TSHRPOLB | |
| SCHEMBL1807480 | 0.77 | PARP1 (0.58) | CYP3A4SMN1; SMN2PARP1TSHRPOLB | |
| SCHEMBL8366010 | 0.77 | DHODH (0.65) | CYP3A4SMN1; SMN2PARP1TSHRPOLB | |
| SCHEMBL1807478 | 0.77 | CYP3A4 (0.44) | CYP3A4SMN1; SMN2PARP1TSHRPOLB |
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-113717406-A | Self-healing ionic gel with high ionic conductivity and preparation and application thereof | 四川大学 | 2021-11-30 | — | — | CN | disclosed |