Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.65 |
| ▸ | CA2 | P00918 | 3/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.61 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.60 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL14703885 | 0.92 | CA1 (0.75) | CA1CA2 | |
| SCHEMBL6380843 | 0.90 | ALDH1A1 (0.70) | CA1CA2POLBKMT2ATAAR1 | |
| SCHEMBL2742529 | 0.88 | CA1 (0.82) | CA1CA2KMT2A | |
| SCHEMBL21328352 | 0.88 | CA1 (0.78) | CA1CA2POLB | |
| SCHEMBL17214300 | 0.87 | CA1 (0.72) | CA1CA2 | |
| SCHEMBL10604740 | 0.86 | CA1 (0.58) | CA1CA2POLBKMT2ATRPV1 | |
| SCHEMBL17212236 | 0.86 | CA1 (0.67) | CA1CA2 | |
| SCHEMBL2925120 | 0.84 | TRPV1 (0.70) | CA1CA2POLBKMT2ATRPV1 | |
| SCHEMBL9313075 | 0.84 | KMT2A (0.70) | CA1CA2POLBKMT2ATAAR1 | |
| SCHEMBL28000837 | 0.84 | KMT2A (0.64) | POLBKMT2ATAAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113416221-B | Total synthesis method of natural product phenanthrene alkaloid glycoside compound H4 | 江西中医药大学 | 2022-03-11 | — | — | CN | claimed |
| CN-113416221-A | Total synthesis method of natural product phenanthrene alkaloid glycoside compound H4 | 江西中医药大学 | 2021-09-21 | — | — | CN | claimed |
| CN-113416221-B | Total synthesis method of natural product phenanthrene alkaloid glycoside compound H4 | 江西中医药大学 | 2022-03-11 | — | — | CN | disclosed |
| CN-113416221-A | Total synthesis method of natural product phenanthrene alkaloid glycoside compound H4 | 江西中医药大学 | 2021-09-21 | — | — | CN | disclosed |