Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2151230 | 0.76 | PARP1 (0.34) | PARP1CA1CA2 | |
| SCHEMBL15940564 | 0.76 | PARP1 (0.34) | PARP1CA1CA2 | |
| SCHEMBL5133900 | 0.76 | PARP1 (0.34) | PARP1CA1CA2 | |
| SCHEMBL2288761 | 0.74 | PARP1 (0.39) | PARP1CA1CA2 | |
| SCHEMBL30274390 | 0.73 | CA1 (0.33) | PARP1CA1CA2 | |
| SCHEMBL29223962 | 0.73 | CA1 (0.33) | PARP1CA1CA2 | |
| SCHEMBL5290390 | 0.72 | PARP1 (0.34) | PARP1CA1CA2 | |
| SCHEMBL28767912 | 0.72 | CA1 (0.32) | PARP1CA1CA2 | |
| SCHEMBL7882155 | 0.71 | PARP1 (0.36) | PARP1CA1CA2 | |
| SCHEMBL1697644 | 0.71 | PARP1 (0.36) | PARP1CA1CA2 |
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-113214182-B | Benzisothiazole compound and preparation method thereof | 佛山湘潭大学绿色智造研究院 | 2022-12-23 | — | — | CN | disclosed |
| US-5043493-A | Isomerization using zeolite catalyst | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-08-27 | — | — | US | disclosed |