Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 7/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 8/20 | 0.40 |
| ▸ | F2 | P00734 | 4/20 | 0.40 |
| ▸ | PYGL | P06737 | 3/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.40 |
| ▸ | PYGM | P11217 | 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 | |
|---|---|---|---|---|
| SCHEMBL741493 | 0.86 | SMYD3 (0.45) | HRH4HRH3CYP51A1PYGLSMYD3 | |
| SCHEMBL742520 | 0.84 | HRH4 (0.44) | HRH4HRH3HRH1CYP51A1F10 | |
| SCHEMBL741864 | 0.82 | SMYD3 (0.42) | CYP51A1PYGLSMYD3PYGM | |
| Hydrochloric Acid SCHEMBL741427 | 0.82 | HRH4 (0.48) | HRH4HRH3HRH1CYP51A1F10 | |
| SCHEMBL4093939 | 0.81 | F10 (0.57) | HRH4HRH3HRH1F10F2 | |
| SCHEMBL5902829 | 0.81 | F10 (0.57) | HRH4HRH3HRH1F10F2 | |
| Hydrochloric Acid SCHEMBL743530 | 0.78 | HRH3 (0.45) | HRH4HRH3HRH1CYP51A1F10 | |
| Hydrochloric Acid SCHEMBL742844 | 0.76 | F10 (0.50) | F10F2 | |
| Hydrochloric Acid SCHEMBL739327 | 0.76 | F10 (0.52) | F10F2 | |
| Hydrochloric Acid SCHEMBL741709 | 0.76 | F10 (0.43) | HRH4HRH3HRH1CYP51A1F10 |
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-2431370-B1 | Monoacylated 1,2-diaminocycloalkanes | DAIICHI SANKYO CO LTD (JP) | 2013-06-19 | — | — | EP | disclosed |
| EP-2431370-A1 | Monoacylated 1,2-diaminocycloalkanes | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2012-03-21 | — | — | EP | disclosed |
| US-7935824-B2 | Ethylenediamine derivatives | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2011-05-03 | — | — | US | disclosed |