Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28500819 | 0.79 | CA1 (0.35) | CA1CA2CA12CA14 | |
| SCHEMBL13485583 | 0.79 | NPSR1 (0.38) | — | |
| SCHEMBL21495970 | 0.79 | CA1 (0.40) | CA1CA2CA12CA14CA9 | |
| Sulfuric Acid SCHEMBL5874371 | 0.77 | CA1 (0.48) | CA1CA2CA12CA14CA9 | |
| Sulfuric Acid SCHEMBL2687555 | 0.77 | CA1 (0.48) | CA1CA2CA12CA14CA9 | |
| SCHEMBL5358 | 0.74 | HRH3 (0.41) | CA1CA2CA12CA14CA9 | |
| SCHEMBL2729745 | 0.74 | HRH3 (0.41) | CA1CA2CA12CA14CA9 | |
| SCHEMBL21224483 | 0.74 | HRH3 (0.41) | CA1CA2CA12CA14CA9 | |
| SCHEMBL12846705 | 0.74 | NPSR1 (0.38) | CA1CA2CA12CA14 | |
| SCHEMBL9165707 | 0.74 | CA1 (0.40) | CA1CA2CA12CA14CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013167297-A2 | METHOD FOR SHAPING KERATINOUS FIBERS | HENKEL AG & CO. KGAA (DE) | 2013-11-14 | — | — | WO | disclosed |