Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | KDM1A | O60341 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8915123 | 1.00 | MAPK1 (0.63) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL8915242 | 1.00 | MAPK1 (0.63) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL8915923 | 1.00 | MAPK1 (0.63) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL11315099 | 0.94 | MAPK1 (0.67) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL9084403 | 0.88 | MAPK1 (0.71) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL10679952 | 0.87 | MAPK1 (0.51) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL8618060 | 0.84 | HSD17B10 (0.56) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL10674136 | 0.82 | CYP1A2 (0.55) | MAPK1CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL8914866 | 0.80 | CYP1A2 (0.88) | CYP1A2CYP2D6CYP2C19ALDH1A1HPGD | |
| SCHEMBL9084215 | 0.80 | CYP1A2 (0.88) | CYP1A2CYP2D6CYP2C19ALDH1A1HPGD |
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-5624917-A | Method of inhibiting squalene synthetase | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-04-29 | — | — | US | disclosed |
| EP-0541037-A2 | Squalene synthetase inhibitory composition and use thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1993-05-12 | — | — | EP | disclosed |