Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.30 |
| ▸ | CA2 | P00918 | 4/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| Thiocyanic Acid SCHEMBL4504379 | 0.86 | CA1 (0.30) | CA1CA2CA5ACA9CA5B | |
| Thiocyanic Acid SCHEMBL4016398 | 0.86 | CA1 (0.30) | CA1CA2CA5ACA9CA5B | |
| Thiocyanic Acid SCHEMBL6232486 | 0.86 | CA1 (0.30) | CA1CA2CA5ACA9CA5B | |
| Thiocyanic Acid SCHEMBL21177322 | 0.86 | TSHR (0.31) | CA1CA2CA5ACA9CA5B | |
| Thiocyanic Acid SCHEMBL21410334 | 0.86 | — | — | |
| Thiocyanic Acid SCHEMBL11270674 | 0.86 | CA1 (0.30) | CA1CA2CA5ACA9CA5B | |
| Thiocyanic Acid SCHEMBL42005 | 0.86 | CA1 (0.30) | CA1CA2CA5ACA9CA5B | |
| Thiocyanic Acid SCHEMBL3862606 | 0.86 | CA1 (0.30) | CA1CA2CA5ACA9CA5B | |
| Thiocyanic Acid SCHEMBL11509407 | 0.86 | — | — | |
| Thiocyanic Acid SCHEMBL5146104 | 0.86 | CA1 (0.30) | CA1CA2CA5ACA9CA5B |
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-2002016660-A1 | REDUCTION METHOD USING PALLADIUM-LOADED BIOLOGICAL CELL AS CATALYST | THE UNIVERSITY OF BIRMINGHAM (GB) | 2002-02-28 | — | — | WO | disclosed |