Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9816818 | 1.00 | TSHR (0.50) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL13174451 | 0.80 | TSHR (0.54) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL16365865 | 0.79 | TSHR (0.48) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL21160229 | 0.78 | ALDH1A1 (0.54) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL16532707 | 0.76 | TSHR (0.50) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL13174334 | 0.76 | TSHR (0.50) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL16000934 | 0.76 | TSHR (0.50) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL16532709 | 0.76 | TSHR (0.50) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL16532708 | 0.75 | TSHR (0.54) | TSHRALDH1A1GAACA12CA1 | |
| SCHEMBL27840741 | 0.74 | ALDH1A1 (0.50) | TSHRALDH1A1GAACA12CA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0220653-B1 | 3-AMINOCARBONYL-1,4-DIHYDROPYRIDINE-5-CARBOXYLIC ACID COMPOUNDS, PROCESS FOR PREPARATION AND USE THEREOF, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | Nippon Shoji Kabushiki Kaisha (JP) | 1991-11-06 | — | — | EP | disclosed |
| US-4874773-A | HYPOTENSIVE AGENTS, VASODILATORS | NIPPON SHOJI KABUSHIKI KAISHA (JP) | 1989-10-17 | — | — | US | disclosed |
| EP-0220653-A2 | 3-Aminocarbonyl-1,4-dihydropyridine-5-carboxylic acid compounds, process for preparation and use thereof, and pharmaceutical composition containing the same | Nippon Shoji Kabushiki Kaisha (JP) | 1987-05-06 | — | — | EP | disclosed |