Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | MGAM | O43451 | 1/20 | 0.42 |
| ▸ | SI | P14410 | 1/20 | 0.42 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.42 |
| ▸ | ADH1B | P00325 | 3/20 | 0.38 |
| ▸ | ADH1A | P07327 | 3/20 | 0.38 |
| ▸ | ADH7 | P40394 | 3/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | ADH1C | P00326 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | ADH4 | P08319 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9668780 | 0.84 | FAAH (0.32) | GAAHSD17B10ADH1BADH1AADH7 | |
| SCHEMBL10959041 | 0.81 | GAA (0.54) | GAAHSD17B10MGAMSIMGAM2 | |
| SCHEMBL9824473 | 0.78 | GAA (0.50) | GAAHSD17B10MGAMSIMGAM2 | |
| SCHEMBL11451516 | 0.78 | HSD17B10 (0.50) | GAAHSD17B10MGAMSIMGAM2 | |
| SCHEMBL9668772 | 0.77 | FAAH (0.31) | ADH1BADH1AADH7 | |
| SCHEMBL10517462 | 0.76 | ADH1B (0.37) | HSD17B10ADH1BADH1AADH7ADH1C | |
| SCHEMBL3388745 | 0.76 | GAA (0.56) | GAAHSD17B10MGAMSIMGAM2 | |
| SCHEMBL8866115 | 0.76 | CES2 (0.55) | GAAHSD17B10MGAMSIMGAM2 | |
| SCHEMBL9667017 | 0.75 | NPSR1 (0.40) | ADH1BADH1AADH7ADH1CMAPT | |
| SCHEMBL9667011 | 0.75 | NPSR1 (0.40) | ADH1BADH1AADH7ADH1CMAPT |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0312541-B1 | 2-(AMINOALKYLTHIO)METHYL-1,4-DIHYDROPYRIDINE, A METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1992-08-26 | — | — | EP | disclosed |
| EP-0254064-B1 | 2-(AMINOALKYLTHIO)METHYL-1,4-DIHYDROPYRIDINE, A METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1992-06-17 | — | — | EP | disclosed |
| US-5047414-A | Hypotensive agents | BOEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) | 1991-09-10 | — | — | US | disclosed |
| EP-0312541-A1 | 2-(AMINOALKYLTHIO)METHYL-1,4-DIHYDROPYRIDINE, A METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM. | BOEHRINGER BIOCHEMIA SRL (IT) | 1989-04-26 | — | — | EP | disclosed |
| EP-0254064-A1 | 2-(Aminoalkylthio)methyl-1,4-dihydropyridine, a method for the preparation thereof and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1988-01-27 | — | — | EP | disclosed |
| WO-1988000187-A1 | 2-(AMINOALKYLTHIO)METHYL-1,4-DIHYDROPYRIDINE, A METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | BOEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) | 1988-01-14 | — | — | WO | disclosed |