Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 6/20 | 0.48 |
| ▸ | NOS2 | P35228 | 5/20 | 0.48 |
| ▸ | BACE1 | P56817 | 3/20 | 0.46 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | NOS3 | P29474 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.36 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.36 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1129404 | 0.85 | KCNH2 (0.52) | NOS1NOS2BACE1NOS3KCNH2 | |
| SCHEMBL28039969 | 0.84 | — | — | |
| SCHEMBL6014618 | 0.82 | NOS1 (0.48) | NOS1NOS2BACE1APPNOS3 | |
| SCHEMBL8725763 | 0.80 | NOS2 (0.39) | NOS1NOS2BACE1APPNOS3 | |
| Hydrochloric Acid SCHEMBL7798240 | 0.80 | NOS1 (0.47) | NOS1NOS2BACE1APPNOS3 | |
| SCHEMBL1540707 | 0.80 | NOS2 (0.52) | NOS1NOS2BACE1APPNOS3 | |
| SCHEMBL30391820 | 0.80 | NOS2 (0.47) | NOS1NOS2BACE1APPNOS3 | |
| SCHEMBL29698872 | 0.80 | NOS2 (0.52) | NOS1NOS2BACE1APPNOS3 | |
| SCHEMBL6454774 | 0.80 | NOS2 (0.47) | NOS1NOS2BACE1APPNOS3 | |
| SCHEMBL19662325 | 0.80 | NOS1 (0.47) | NOS1NOS2BACE1APPNOS3 |
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 |