Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KAT2B | Q92831 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL371170 | 0.83 | TSHR (0.62) | TSHRCYP3A4GPR35MAPTALDH1A1 | |
| SCHEMBL8653035 | 0.81 | TSHR (0.60) | TSHRCYP3A4GPR35MAPTALDH1A1 | |
| SCHEMBL16952822 | 0.81 | TSHR (0.60) | TSHRCYP3A4GPR35MAPTALDH1A1 | |
| SCHEMBL6377970 | 0.78 | MAPK1 (0.58) | TSHRALDH1A1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL12367389 | 0.76 | TSHR (0.53) | TSHRCYP3A4MAPTALDH1A1KMT2A | |
| SCHEMBL294724 | 0.76 | TSHR (1.00) | TSHRCYP3A4GPR35MAPTALDH1A1 | |
| SCHEMBL10969566 | 0.75 | TSHR (0.51) | TSHRCYP3A4MAPTALDH1A1KMT2A | |
| SCHEMBL8112559 | 0.75 | MAPT (0.62) | TSHRCYP3A4MAPTALDH1A1KMT2A | |
| SCHEMBL557939 | 0.74 | TSHR (0.72) | TSHRCYP3A4GPR35MAPTALDH1A1 | |
| SCHEMBL405824 | 0.73 | TSHR (0.49) | TSHRCYP3A4MAPTALDH1A1KMT2A |
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 |