Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 6/20 | 0.51 |
| ▸ | NPC1 | O15118 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7983167 | 0.76 | GGPS1 (0.48) | KDM4EALDH1A1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL7979860 | 0.76 | PDE10A (0.42) | KDM4EALDH1A1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL7969877 | 0.75 | ALDH1A1 (0.49) | KDM4EALDH1A1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL24273206 | 0.75 | KDM4E (0.67) | KDM4EALDH1A1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL7983003 | 0.75 | KDM4E (0.67) | KDM4EALDH1A1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL24862850 | 0.75 | KDM4E (0.67) | KDM4EALDH1A1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL7983166 | 0.74 | PTGS1 (0.49) | KDM4EALDH1A1SMN1; SMN2TDP1LMNA | |
| SCHEMBL5354841 | 0.74 | KDM4E (0.56) | KDM4EALDH1A1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL7980785 | 0.72 | KDM4E (0.62) | KDM4EALDH1A1RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL5373208 | 0.71 | KDM4E (0.71) | KDM4EALDH1A1RAB9ANPC1SMN1; 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 |