Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.53 |
| ▸ | HPGD | P15428 | 7/20 | 0.53 |
| ▸ | RAB9A | P51151 | 7/20 | 0.50 |
| ▸ | GLA | P06280 | 7/20 | 0.47 |
| ▸ | GAA | P10253 | 7/20 | 0.47 |
| ▸ | PDE5A | O76074 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.46 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7980862 | 0.77 | PTGS1 (0.47) | KDM4EALDH1A1HPGDRAB9AHSD17B10 | |
| SCHEMBL7982687 | 0.74 | DHFR (0.41) | KDM4EALDH1A1RAB9AHSD17B10MEN1 | |
| SCHEMBL7981083 | 0.73 | HRH4 (0.42) | KDM4EALDH1A1HPGDRAB9AGAA | |
| SCHEMBL25347598 | 0.73 | ALDH1A1 (0.56) | KDM4EALDH1A1HPGDRAB9AGLA | |
| SCHEMBL7986876 | 0.70 | ALDH1A1 (0.64) | KDM4EALDH1A1HPGDRAB9AGLA | |
| SCHEMBL700968 | 0.70 | PDE4A (0.45) | KDM4EALDH1A1RAB9ACYP1A2TP53 | |
| SCHEMBL1407731 | 0.69 | KDM4E (1.00) | KDM4EALDH1A1HPGDRAB9AGLA | |
| SCHEMBL9737854 | 0.69 | ALDH1A1 (0.43) | KDM4EALDH1A1RAB9AGLAGAA | |
| SCHEMBL7983595 | 0.69 | PDE4A (0.39) | KDM4EALDH1A1RAB9AGLAGAA | |
| SCHEMBL10205883 | 0.68 | KDM4E (0.50) | KDM4EALDH1A1HPGDRAB9AGLA |
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 |