Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.58 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6589356 | 0.94 | KCNA3 (0.64) | KCNA3CA12CA1CA9PTGS2 | |
| SCHEMBL29054813 | 0.80 | KCNA3 (0.64) | KCNA3CA12CA1CA9PTGS2 | |
| SCHEMBL6589264 | 0.80 | KCNA3 (0.63) | KCNA3CA12CA1CA9MAOB | |
| SCHEMBL29054932 | 0.79 | KCNA3 (0.62) | KCNA3CA12CA1CA9PTGS2 | |
| SCHEMBL24237028 | 0.77 | KCNA3 (0.63) | KCNA3CA12CA1CA9MAOB | |
| SCHEMBL29054826 | 0.76 | KCNA3 (0.66) | KCNA3CA12CA1CA9PTGS2 | |
| SCHEMBL24523108 | 0.76 | KCNA3 (0.55) | KCNA3CA12CA1CA9PTGS2 | |
| SCHEMBL24522970 | 0.76 | KCNA3 (0.55) | KCNA3CA12CA1CA9PTGS2 | |
| SCHEMBL7475370 | 0.76 | KCNA3 (0.55) | KCNA3CA12CA1CA9PTGS2 | |
| SCHEMBL29054926 | 0.75 | KCNA3 (0.64) | KCNA3CA12CA1CA9PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1214315-A1 | 1,4-DIHYDROPYRIDINE-5-CARBOXYLIC ACID ESTER DERIVATIVES AND METHOD FOR THE PREPARATION THEREOF | Rephartox (NL) | 2002-06-19 | — | — | EP | disclosed |
| WO-2001014370-A1 | 1,4-DIHYDROPYRIDINE-5-CARBOXYLIC ACID ESTER DERIVATIVES AND METHOD FOR THE PREPARATION THEREOF | REPHARTOX (NL) | 2001-03-01 | — | — | WO | disclosed |