Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.51 |
| ▸ | PYGL | P06737 | 16/20 | 0.48 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.46 |
| ▸ | PYGM | P11217 | 6/20 | 0.45 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL742116 | 0.85 | SMYD3 (0.47) | SMYD3PYGLPYGMEHMT2 | |
| SCHEMBL743187 | 0.83 | F10 (0.46) | SMYD3PYGLCYP51A1EHMT2 | |
| SCHEMBL741602 | 0.82 | F10 (0.46) | SMYD3PYGLCYP51A1 | |
| SCHEMBL743656 | 0.80 | F10 (0.56) | — | |
| SCHEMBL743192 | 0.80 | F10 (0.46) | SMYD3PYGLCYP51A1 | |
| SCHEMBL739574 | 0.79 | F10 (0.45) | SMYD3PYGLCYP51A1PYGM | |
| SCHEMBL4095868 | 0.78 | SMYD3 (0.54) | SMYD3PYGLEHMT2 | |
| SCHEMBL3335058 | 0.78 | SMYD3 (0.54) | SMYD3PYGLEHMT2 | |
| SCHEMBL4083427 | 0.78 | SMYD3 (0.54) | SMYD3PYGLEHMT2 | |
| SCHEMBL3335060 | 0.78 | SMYD3 (0.54) | SMYD3PYGLEHMT2 |
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 4 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 |
| EP-1270557-A1 | ETHYLENEDIAMINE DERIVATIVES | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2003-01-02 | — | — | EP | disclosed |