Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 14/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 14/20 | 0.64 |
| ▸ | HPGD | P15428 | 11/20 | 0.64 |
| ▸ | NPC1 | O15118 | 5/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.49 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | GLA | P06280 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11822743 | 0.79 | KDM4E (0.60) | ALDH1A1KDM4EHPGDNPC1SMN1; SMN2 | |
| SCHEMBL1407731 | 0.78 | KDM4E (1.00) | ALDH1A1KDM4EHPGDNPC1SMN1; SMN2 | |
| SCHEMBL1668064 | 0.77 | ALDH1A1 (0.60) | ALDH1A1KDM4EHPGDNPC1SMN1; SMN2 | |
| SCHEMBL20596629 | 0.75 | ALDH1A1 (0.47) | ALDH1A1KDM4EHPGDNPC1SMN1; SMN2 | |
| SCHEMBL7982689 | 0.74 | ALDH1A1 (0.46) | ALDH1A1KDM4EHPGDNPC1SMN1; SMN2 | |
| SCHEMBL20595996 | 0.74 | KDM4E (0.43) | ALDH1A1KDM4EHPGDSMN1; SMN2RAB9A | |
| SCHEMBL10205883 | 0.73 | KDM4E (0.50) | ALDH1A1KDM4EHPGDNPC1SMN1; SMN2 | |
| SCHEMBL9946224 | 0.73 | KDM4E (0.56) | ALDH1A1KDM4EHPGDNPC1SMN1; SMN2 | |
| SCHEMBL7981086 | 0.73 | KDM4E (0.44) | ALDH1A1KDM4EHPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL13764284 | 0.73 | MEN1 (0.40) | ALDH1A1KDM4EHPGDSMN1; SMN2HSD17B10 |
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 |