Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 19/20 | 0.57 |
| ▸ | CA2 | P00918 | 19/20 | 0.57 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11079988 | 1.00 | CA1 (0.57) | CA1CA2CA7CA13 | |
| SCHEMBL11079985 | 1.00 | CA1 (0.57) | CA1CA2CA7CA13 | |
| SCHEMBL11090797 | 0.90 | CA1 (0.51) | CA1CA2CA7CA13 | |
| SCHEMBL11090781 | 0.90 | CA1 (0.51) | CA1CA2CA7CA13 | |
| SCHEMBL11084531 | 0.79 | CA2 (0.44) | CA1CA2 | |
| SCHEMBL11089460 | 0.79 | ACE (0.45) | CA1CA2 | |
| SCHEMBL11084537 | 0.79 | CA2 (0.44) | CA1CA2 | |
| SCHEMBL11089449 | 0.79 | ACE (0.45) | CA1CA2 | |
| SCHEMBL11087447 | 0.78 | CA1 (0.61) | CA1CA2CA7CA13 | |
| SCHEMBL11309604 | 0.76 | CA1 (0.40) | CA1CA2CA7CA13 |
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 |
|---|---|---|---|---|---|---|---|
| JP-56123965-A | — | — | None | — | — | JP | disclosed |
| JP-S56123965-A | PREPARATION OF 3-SUBSTITUTED BENZOYLTHIO-2 S - METHYLPROPIONIC ACID | YOSHITOMI PHARMACEUT IND LTD | 1981-09-29 | — | — | JP | disclosed |