Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | GAA | P10253 | 4/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | GFER | P55789 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL7682946 | 0.89 | ALDH1A1 (0.61) | ALDH1A1GAASMN1; SMN2TDP1KDM4E | |
| SCHEMBL7678997 | 0.87 | ALDH1A1 (0.59) | ALDH1A1GAASMN1; SMN2TDP1KDM4E | |
| SCHEMBL7689683 | 0.82 | ALDH1A1 (0.58) | ALDH1A1GAASMN1; SMN2TDP1KDM4E | |
| SCHEMBL7689236 | 0.82 | ALDH1A1 (0.60) | ALDH1A1GAASMN1; SMN2TDP1KDM4E | |
| SCHEMBL7683121 | 0.79 | ALDH1A1 (0.60) | ALDH1A1GAASMN1; SMN2TDP1KDM4E | |
| SCHEMBL7689688 | 0.76 | ALDH1A1 (0.67) | ALDH1A1GAASMN1; SMN2TDP1KDM4E | |
| SCHEMBL8129934 | 0.73 | TP53 (0.43) | ALDH1A1GAATDP1KDM4ECYP1A2 | |
| SCHEMBL7689686 | 0.71 | ALDH1A1 (0.66) | ALDH1A1GAASMN1; SMN2GFERLMNA | |
| SCHEMBL7680873 | 0.68 | TP53 (0.61) | ALDH1A1SMN1; SMN2KDM4EALOX12POLB | |
| SCHEMBL28710849 | 0.67 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2TDP1POLBMAPT |
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-6350749-B1 | SODIUM CHANNEL MODULATORS, ANTIARRHYTHMIA AND HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS, ANGINA PECTORIS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-02-26 | — | — | US | disclosed |