Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | ZDHHC20 | Q5W0Z9 | 2/20 | 0.39 |
| ▸ | ZDHHC2 | Q9UIJ5 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 5/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | QPCT | Q16769 | 2/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7758081 | 1.00 | ALDH1A1 (0.46) | ALDH1A1ZDHHC20ZDHHC2HRH4SMN1; SMN2 | |
| SCHEMBL7753802 | 0.81 | HRH4 (0.45) | HRH4HRH3 | |
| SCHEMBL7753798 | 0.81 | HRH4 (0.45) | HRH4HRH3 | |
| SCHEMBL10578435 | 0.77 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2CYP1A2GAACYP2D6 | |
| SCHEMBL7758091 | 0.76 | HRH4 (0.41) | ALDH1A1HRH4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11484378 | 0.76 | HRH4 (0.51) | ZDHHC20ZDHHC2HRH4SMN1; SMN2CYP1A2 | |
| SCHEMBL11527425 | 0.72 | GRIN2D (0.39) | HRH4QPCT | |
| SCHEMBL11527422 | 0.72 | GRIN2D (0.39) | HRH4QPCT | |
| SCHEMBL14208779 | 0.70 | GRIN2D (0.40) | ZDHHC20ZDHHC2SMN1; SMN2CYP1A2MEN1 | |
| SCHEMBL13684632 | 0.70 | GRIN2D (0.40) | ZDHHC20ZDHHC2SMN1; SMN2CYP1A2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1077933-A1 | SUBSTITUTED GUANIDINES AND DIAMINONITROETHENES, THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 2001-02-28 | — | — | EP | disclosed |
| US-6147098-A | USEFUL IN THE TREATMENT OF DISEASES OF THE CENTRAL NERVOUS SYSTEM, CARDIOVASCULAR SYSTEM, PULMONARY SYSTEM, GASTROINTESTINAL SYSTEM AND ENDOCRINOLOGIC SYSTEM | NOVO NORDISK A/S (DK) | 2000-11-14 | — | — | US | disclosed |
| WO-1999058497-A1 | SUBSTITUTED GUANIDINES AND DIAMINONITROETHENES, THEIR PREPARATION AND USE | NOVO NORDISK A/S (DK) | 1999-11-18 | — | — | WO | disclosed |