Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10484429 | 0.79 | CA1 (0.42) | CA1CA2CA4CA6 | |
| SCHEMBL15797821 | 0.78 | — | — | |
| SCHEMBL11199730 | 0.78 | TSHR (0.39) | CA1CA2 | |
| SCHEMBL29197402 | 0.71 | MAOA (0.39) | CA1CA2CA4CA6 | |
| SCHEMBL578709 | 0.71 | CYP2A6 (0.32) | — | |
| SCHEMBL7471146 | 0.67 | KDM4E (0.37) | — | |
| SCHEMBL7471143 | 0.67 | — | — | |
| SCHEMBL725638 | 0.66 | MAOA (0.52) | — | |
| SCHEMBL17200851 | 0.65 | ALDH1A1 (0.33) | — | |
| SCHEMBL25131 | 0.65 | ALDH1A1 (0.46) | — |
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-2006017406-A1 | CYANOAMIDINE P2X7 ANTAGONISTS FOR THE TREATMENT OF PAIN | ABBOTT LABORATORIES (US) | 2006-02-16 | — | — | WO | claimed |