Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL719016 | 0.97 | CA5A (0.38) | CA5ACA5BALDH1A1TDP1 | |
| SCHEMBL3141166 | 0.73 | CA5A (0.50) | CA5ACA5BALDH1A1TDP1 | |
| SCHEMBL27836960 | 0.71 | CYP1A2 (0.32) | — | |
| SCHEMBL18430090 | 0.71 | CA5A (0.33) | CA5ACA5BALDH1A1TDP1 | |
| Ammonia Solution, Strong SCHEMBL11792060 | 0.70 | CA5A (0.46) | CA5ACA5BALDH1A1TDP1 | |
| SCHEMBL17677262 | 0.69 | — | — | |
| SCHEMBL4611226 | 0.67 | CA5A (0.43) | CA5ACA5BALDH1A1TDP1 | |
| SCHEMBL321132 | 0.67 | — | — | |
| SCHEMBL16726915 | 0.67 | CYP1A2 (0.33) | CA5ACA5B | |
| SCHEMBL8307520 | 0.65 | — | — |
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-109251115-B | Energetic functionalized graphene oxide and preparation method thereof | 浙江工业大学 | 2021-10-15 | — | — | CN | claimed |
| CN-109251115-B | Energetic functionalized graphene oxide and preparation method thereof | 浙江工业大学 | 2021-10-15 | — | — | CN | disclosed |