Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | FKBP1A | P62942 | 3/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | PSMD10 | O75832 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2567795 | 0.87 | ALDH1A1 (0.47) | CA12CA1CA9FKBP1APSMD10 | |
| SCHEMBL18934371 | 0.87 | ALDH1A1 (0.47) | CA12CA1CA9FKBP1APSMD10 | |
| SCHEMBL13649253 | 0.85 | ENPP1 (0.52) | CA12CA1CA9FKBP1AENPP1 | |
| SCHEMBL8780852 | 0.85 | FKBP1A (0.53) | FKBP1APSMD10ALDH1A1KMT2ACNR2 | |
| SCHEMBL13509528 | 0.85 | CA12 (0.41) | CA12CA1CA9FKBP1ADRD2 | |
| SCHEMBL7371569 | 0.84 | AR (0.56) | CA12CA1CA9DRD2DRD4 | |
| SCHEMBL18926560 | 0.83 | GAA (0.50) | CA12CA1CA9FKBP1APSMD10 | |
| SCHEMBL18926554 | 0.82 | CA2 (0.53) | CA12CA1CA9PSMD10KCNH2 | |
| SCHEMBL10939470 | 0.82 | ALDH1A1 (0.47) | FKBP1APSMD10ENPP1ALDH1A1CYP2C9 | |
| SCHEMBL2333789 | 0.81 | ALDH1A1 (0.51) | FKBP1AALDH1A1CNR2BCHEACHE |
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-1994002463-A1 | ANTIHYPERTENSIVE 1,4-DIHYDROPYRIDINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-02-03 | — | — | WO | disclosed |