Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.51 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.51 |
| ▸ | NOS1 | P29475 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL3539057 | 0.74 | SMN1; SMN2 (0.52) | HSD17B10GABRA5GABRB2NOS1SMN1; SMN2 | |
| SCHEMBL11926737 | 0.74 | HSD17B10 (0.70) | HSD17B10GABRA5GABRB2NOS1SMN1; SMN2 | |
| Acetamide SCHEMBL9942181 | 0.73 | GABRA5 (0.50) | HSD17B10GABRA5GABRB2NOS1SMN1; SMN2 | |
| SCHEMBL307817 | 0.73 | — | — | |
| SCHEMBL2655261 | 0.73 | GABRA5 (0.68) | HSD17B10GABRA5GABRB2NOS1SMN1; SMN2 | |
| Acetic Acid SCHEMBL1340575 | 0.73 | HSD17B10 (0.62) | HSD17B10GABRA5GABRB2NOS1SMN1; SMN2 | |
| Acetic Acid SCHEMBL4983698 | 0.73 | HSD17B10 (0.62) | HSD17B10GABRA5GABRB2NOS1SMN1; SMN2 | |
| SCHEMBL7980749 | 0.72 | NOS2 (0.42) | NOS1 | |
| SCHEMBL9271595 | 0.72 | GABRA5 (0.49) | HSD17B10GABRA5GABRB2NOS1SMN1; SMN2 | |
| Acetic Acid SCHEMBL27742442 | 0.71 | HSD17B10 (0.89) | HSD17B10GABRA5GABRB2NOS1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6174877-B1 | EXCELLANT BACTERICIDES, ORAL ABSORBABILITY AND STABILITY; IMPROVE THE STABILITY TO RENAL DEHYDROPEPTIDASE I (DHP-I); 2-(2-(N-HETEROCYCLIC-ETHYLTHIO-) DERIVATIVES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-01-16 | — | — | US | disclosed |
| EP-0876370-A1 | CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1998-11-11 | — | — | EP | disclosed |
| WO-1997025325-A1 | CARBAPENEM COMPOUNDS, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-07-17 | — | — | WO | disclosed |