Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH3 | Q9ULD8 | 4/20 | 0.44 |
| ▸ | CA1 | P00915 | 4/20 | 0.43 |
| ▸ | CA2 | P00918 | 4/20 | 0.43 |
| ▸ | CA9 | Q16790 | 4/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CDK1 | P06493 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.41 |
| ▸ | GBA1 | P04062 | 3/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.40 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.40 |
| ▸ | CHAT | P28329 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17808450 | 0.99 | CA1 (0.44) | KCNH3CA1CA2CA9CA12 | |
| SCHEMBL10198856 | 0.94 | ROCK1 (0.41) | KCNH3CA1CA2CA9CA12 | |
| SCHEMBL15984410 | 0.90 | KCNH3 (0.55) | KCNH3CA1CA2CA9CA12 | |
| SCHEMBL15804162 | 0.89 | CA1 (0.48) | KCNH3CA1CA2CA9CA12 | |
| SCHEMBL15840096 | 0.89 | KCNH3 (0.42) | KCNH3CA1CA2CA9CA12 | |
| SCHEMBL15984406 | 0.87 | CA1 (0.54) | KCNH3CA1CA2CA9GBA1 | |
| SCHEMBL15804188 | 0.87 | IDH2 (0.42) | KCNH3CA1CA2CA9CA12 | |
| SCHEMBL15804169 | 0.85 | GBA1 (0.39) | KCNH3CA1CA2CA9CA12 | |
| SCHEMBL13705645 | 0.85 | CA1 (0.46) | KCNH3CA1CA2CA9CA12 | |
| SCHEMBL15804187 | 0.85 | RECQL (0.50) | KCNH3CA1CA2CA9CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-20160160065-A1 | INK COMPOSITION, INK JET RECORDING METHOD USING SAME, AND COLORED MATERIAL | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2016-06-09 | — | — | US | disclosed |