Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 4/20 | 0.44 |
| ▸ | CA2 | P00918 | 4/20 | 0.44 |
| ▸ | CA9 | Q16790 | 4/20 | 0.44 |
| ▸ | CA4 | P22748 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.43 |
| ▸ | CSNK2B | P67870 | 2/20 | 0.43 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27527583 | 0.85 | CA1 (0.35) | MAP1LC3BCA1CA2CA9CA4 | |
| SCHEMBL7683230 | 0.82 | CA1 (0.50) | MAP1LC3BCA1CA2CA9CA4 | |
| SCHEMBL7686928 | 0.79 | MAP1LC3B (0.50) | MAP1LC3BCA1CA2CA9CA4 | |
| SCHEMBL7686746 | 0.77 | LMNA (0.43) | MAP1LC3BCA1CA2CA9CA4 | |
| SCHEMBL7687667 | 0.75 | CSNK2A2 (0.44) | MAP1LC3BCA1CA2CA9CA4 | |
| SCHEMBL7685208 | 0.73 | MAP1LC3B (0.44) | MAP1LC3BHPGDCSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL7689177 | 0.71 | CSNK2A2 (0.54) | MAP1LC3BCA1CA2CA9CA4 | |
| SCHEMBL7690090 | 0.70 | ALDH1A1 (0.49) | MAP1LC3BCA1CA2CA9CA4 | |
| Hydrochloric Acid SCHEMBL27549187 | 0.67 | ALDH1A1 (0.35) | CA1CA2CA9CA4HPGD | |
| SCHEMBL6124100 | 0.64 | CYP19A1 (0.77) | MAP1LC3BHPGDKMT2AMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6350749-B1 | SODIUM CHANNEL MODULATORS, ANTIARRHYTHMIA AND HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS, ANGINA PECTORIS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-02-26 | — | — | US | disclosed |
| EP-1057812-A1 | AMINOGUANIDINE HYDRAZONE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND DRUGS THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2000-12-06 | — | — | EP | disclosed |