Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.71 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.71 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.71 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.71 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.71 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.58 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.52 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.52 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL4751471 | 0.84 | NPSR1 (0.80) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4751899 | 0.84 | ALDH1A1 (0.80) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4751903 | 0.84 | ALDH1A1 (0.80) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4749282 | 0.83 | ALDH1A1 (0.74) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4751462 | 0.83 | NPSR1 (0.78) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4751451 | 0.83 | NPSR1 (0.78) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4749266 | 0.83 | ALDH1A1 (0.73) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4749674 | 0.78 | NPSR1 (0.67) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4752213 | 0.77 | ALDH1A1 (0.65) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4753007 | 0.74 | LMNA (0.77) | ALDH1A1NPSR1CYP1A2CYP2C9CYP2C19 |
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-2008140214-A1 | USE OF AMINOTHIOPHENE DERIVATIVE FOR PREVENTING OR TREATING ISCHEMIC DISEASES | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2008-11-20 | — | — | WO | disclosed |