Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9816659 | 1.00 | TSHR (0.45) | TSHRALDH1A1SMN1; SMN2MAPTKMT2A | |
| SCHEMBL4205555 | 0.83 | SMN1; SMN2 (0.45) | TSHRALDH1A1SMN1; SMN2MAPTKMT2A | |
| SCHEMBL11049989 | 0.78 | ALDH1A1 (0.40) | TSHRALDH1A1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL15482579 | 0.78 | KMT2A (0.42) | TSHRALDH1A1SMN1; SMN2MAPTKMT2A | |
| SCHEMBL15780411 | 0.76 | — | — | |
| SCHEMBL15482637 | 0.75 | SMN1; SMN2 (0.38) | TSHRALDH1A1SMN1; SMN2MAPTKMT2A | |
| SCHEMBL15482567 | 0.75 | FAAH (0.47) | TSHRALDH1A1SMN1; SMN2MAPTKMT2A | |
| Acrylamide SCHEMBL9362700 | 0.74 | ALDH1A1 (0.52) | TSHRALDH1A1SMN1; SMN2MAPTKMT2A | |
| SCHEMBL11052618 | 0.74 | KDM4E (0.46) | ALDH1A1SMN1; SMN2MAPTKMT2AKDM4E | |
| Butanedione SCHEMBL27637216 | 0.74 | ALDH1A1 (0.48) | TSHRALDH1A1SMN1; SMN2MAPTKMT2A |
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 |