Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18635296 | 0.77 | CA1 (0.35) | CA1CA2CA7CA13 | |
| SCHEMBL2256986 | 0.77 | CA1 (0.35) | CA1CA2CA7CA13 | |
| SCHEMBL2203409 | 0.69 | CA1 (0.39) | CA1CA2CA7CA13 | |
| SCHEMBL12667186 | 0.69 | CA1 (0.39) | CA1CA2CA7CA13 | |
| SCHEMBL5634477 | 0.69 | CA1 (0.39) | CA1CA2CA7CA13 | |
| SCHEMBL14838883 | 0.69 | CA1 (0.39) | CA1CA2CA7CA13 | |
| SCHEMBL15850460 | 0.69 | CA1 (0.39) | CA1CA2CA7CA13 | |
| SCHEMBL18680877 | 0.69 | CES1 (0.31) | — | |
| SCHEMBL6008936 | 0.69 | ALDH1A1 (0.41) | — | |
| SCHEMBL177619 | 0.67 | CA1 (0.50) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102369172-A | Radiolabelling methods | HAMMERSMITH IMANET LTD | 2012-03-07 | — | — | CN | disclosed |