Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.46 |
| ▸ | CASP6 | P55212 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23409303 | 0.75 | HKDC1 (0.58) | HKDC1CASP6CTSB | |
| SCHEMBL29940073 | 0.74 | HKDC1 (0.53) | HKDC1CASP6CTSB | |
| SCHEMBL23043391 | 0.74 | HKDC1 (0.53) | HKDC1CASP6CTSB | |
| SCHEMBL29418744 | 0.70 | HKDC1 (0.58) | HKDC1CASP6CTSB | |
| SCHEMBL23043385 | 0.70 | HKDC1 (0.58) | HKDC1CASP6CTSB | |
| SCHEMBL4880191 | 0.68 | CTSB (0.55) | HKDC1CASP6CTSB | |
| SCHEMBL30064912 | 0.68 | CTSB (0.55) | HKDC1CASP6CTSB | |
| SCHEMBL26197128 | 0.68 | TAAR1 (0.41) | TAAR1 | |
| SCHEMBL25822334 | 0.68 | HTR2A (0.34) | TAAR1 | |
| SCHEMBL30259983 | 0.67 | HKDC1 (0.49) | HKDC1CASP6CTSB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023125989-A1 | QUINAZOLINE COMPOUND AND APPLICATION THEREOF | 上海医药集团股份有限公司 | 2023-07-06 | — | — | WO | disclosed |