Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | RAB9A | P51151 | 6/20 | 0.50 |
| ▸ | NPC1 | O15118 | 5/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.43 |
| ▸ | HTR5A | P47898 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 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 | |
|---|---|---|---|---|
| SCHEMBL5373208 | 0.85 | KDM4E (0.71) | KDM4EALDH1A1RAB9ANPC1HPGD | |
| SCHEMBL24273206 | 0.81 | KDM4E (0.67) | KDM4EALDH1A1RAB9ANPC1HPGD | |
| SCHEMBL7979647 | 0.81 | KDM4E (0.67) | KDM4EALDH1A1RAB9ANPC1HPGD | |
| SCHEMBL24862850 | 0.81 | KDM4E (0.67) | KDM4EALDH1A1RAB9ANPC1HPGD | |
| SCHEMBL1520693 | 0.79 | KDM4E (0.62) | KDM4EALDH1A1RAB9ANPC1HPGD | |
| SCHEMBL20858108 | 0.77 | KDM4E (0.61) | KDM4EALDH1A1RAB9ANPC1HPGD | |
| SCHEMBL5359262 | 0.77 | KDM4E (0.71) | KDM4EALDH1A1RAB9ANPC1HPGD | |
| SCHEMBL8350565 | 0.77 | KDM4E (0.71) | KDM4EALDH1A1RAB9ANPC1HPGD | |
| SCHEMBL14759162 | 0.77 | KDM4E (0.71) | KDM4EALDH1A1RAB9ANPC1HPGD | |
| Hydrochloric Acid SCHEMBL14759243 | 0.76 | KDM4E (0.69) | KDM4EALDH1A1RAB9ANPC1HPGD |
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 |