Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | ACHE | P22303 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | PLK1 | P53350 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | PGR | P06401 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2627195 | 0.83 | DYRK1A (0.53) | TSHRACHELMNAMAPTRAB9A | |
| SCHEMBL2144876 | 0.81 | TSHR (0.50) | TSHRACHELMNAMAPTRAB9A | |
| SCHEMBL22347160 | 0.81 | PDE4D (0.52) | PDE4DTSHRACHELMNAPLK1 | |
| SCHEMBL6738366 | 0.80 | TSHR (0.76) | TSHRACHELMNAMAPTRAB9A | |
| SCHEMBL2685194 | 0.80 | CYP19A1 (0.43) | TSHRMAPTRAB9ANPC1ALDH1A1 | |
| SCHEMBL2684592 | 0.80 | CYP19A1 (0.43) | TSHRLMNAMAPTRAB9ANPC1 | |
| SCHEMBL30469329 | 0.80 | PDE4D (0.49) | PDE4DTSHRACHELMNAPLK1 | |
| SCHEMBL20557352 | 0.80 | PDE4D (0.49) | PDE4DTSHRACHELMNAPLK1 | |
| SCHEMBL2649031 | 0.80 | MAPT (0.64) | PDE4DTSHRLMNAMAPTRAB9A | |
| SCHEMBL28134363 | 0.79 | PDE4D (0.58) | PDE4DTSHRACHELMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0160451-B1 | DIHYDROPYRIDINE-3,5-DICARBOXYLIC ACID ESTER DERIVATIVE ISOMERS, THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1991-08-28 | — | — | EP | claimed |