Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | POLA1 | P09884 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10686341 | 1.00 | CES1 (0.39) | CES1CES2MAPTRAB9ANPSR1 | |
| SCHEMBL5452973 | 0.88 | HCAR2 (0.39) | CES1CES2MAPTRAB9ANPSR1 | |
| SCHEMBL5452972 | 0.88 | HCAR2 (0.39) | CES1CES2MAPTRAB9ANPSR1 | |
| SCHEMBL9454862 | 0.82 | TSHR (0.40) | MAPTRAB9ANPSR1MEN1KMT2A | |
| SCHEMBL1970546 | 0.82 | NPSR1 (0.47) | CES1CES2MAPTRAB9ANPSR1 | |
| SCHEMBL9454865 | 0.82 | TSHR (0.40) | MAPTRAB9ANPSR1MEN1KMT2A | |
| SCHEMBL1970684 | 0.82 | NPSR1 (0.47) | CES1CES2MAPTRAB9ANPSR1 | |
| SCHEMBL7166250 | 0.82 | NPSR1 (0.47) | CES1CES2MAPTRAB9ANPSR1 | |
| SCHEMBL10685445 | 0.80 | ATM (0.43) | CES1CES2MAPTRAB9ANPSR1 | |
| SCHEMBL10684914 | 0.79 | LMNA (0.46) | CES1CES2MAPTRAB9ANPSR1 |
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-4761420-A | CARDIOVASCULAR DISORDERS | LABORATOIRES SYNTEX S.A. (FR) | 1988-08-02 | — | — | US | disclosed |
| EP-0249245-A2 | Antihypertensive dihydropyridine derivatives | LABORATOIRES SYNTEX S.A. (FR) | 1987-12-16 | — | — | EP | disclosed |