Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 7/20 | 0.46 |
| ▸ | CA1 | P00915 | 7/20 | 0.46 |
| ▸ | CA2 | P00918 | 7/20 | 0.46 |
| ▸ | CA9 | Q16790 | 7/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TYMP | P19971 | 3/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 6/20 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL29174403 | 0.99 | CA12 (0.47) | CA12CA1CA2CA9LMNA | |
| Trifluoroacetic Acid SCHEMBL29174362 | 0.95 | CA12 (0.48) | CA12CA1CA2CA9LMNA | |
| Trifluoroacetic Acid SCHEMBL29174399 | 0.90 | CA12 (0.50) | CA12CA1CA2CA9LMNA | |
| SCHEMBL17783197 | 0.88 | CA12 (0.56) | CA12CA1CA2CA9LMNA | |
| SCHEMBL15710355 | 0.88 | CA12 (0.56) | CA12CA1CA2CA9LMNA | |
| SCHEMBL28588942 | 0.88 | CA12 (0.56) | CA12CA1CA2CA9LMNA | |
| SCHEMBL28572545 | 0.88 | CA12 (0.56) | CA12CA1CA2CA9LMNA | |
| SCHEMBL4357511 | 0.87 | CA12 (0.57) | CA12CA1CA2CA9LMNA | |
| Trifluoroacetic Acid SCHEMBL29174366 | 0.83 | CA12 (0.44) | CA12CA1CA2CA9LMNA | |
| SCHEMBL4360078 | 0.83 | CA12 (0.58) | CA12CA1CA2CA9LMNA |
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-114957224-B | EGFR inhibitor for tumor hypoxia targeting and application thereof | 浙大城市学院 | 2024-03-19 | — | — | CN | disclosed |
| CN-114957224-A | Tumor hypoxia-targeted EGFR inhibitor and application thereof | 浙大城市学院 | 2022-08-30 | — | — | CN | disclosed |