Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.42 |
| ▸ | PYGL | P06737 | 13/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PYGM | P11217 | 6/20 | 0.40 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.40 |
| ▸ | GUSB | P08236 | 1/20 | 0.39 |
| ▸ | F7 | P08709 | 1/20 | 0.39 |
| ▸ | F3 | P13726 | 1/20 | 0.39 |
| ▸ | NHERF1 | O14745 | 1/20 | 0.38 |
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 | 0.88 | SMYD3 (0.45) | SMYD3PYGLCYP51A1F7F3 | |
| SCHEMBL742520 | 0.82 | HRH4 (0.44) | PYGLMEN1RAB9AKMT2ACYP51A1 | |
| SCHEMBL740465 | 0.82 | HRH4 (0.48) | SMYD3PYGLPYGMCYP51A1 | |
| SCHEMBL4088716 | 0.79 | F10 (0.56) | SMYD3PYGLPYGM | |
| SCHEMBL4088719 | 0.79 | F10 (0.56) | SMYD3PYGLPYGM | |
| Hydrochloric Acid SCHEMBL743335 | 0.77 | SMYD3 (0.46) | SMYD3PYGLCYP51A1NHERF1 | |
| SCHEMBL739788 | 0.76 | SMYD3 (0.51) | SMYD3PYGLMEN1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL741885 | 0.76 | CNR1 (0.47) | SMYD3PYGLCYP51A1 | |
| Hydrochloric Acid SCHEMBL741745 | 0.75 | SMYD3 (0.50) | SMYD3PYGLMEN1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL742479 | 0.75 | SMYD3 (0.41) | SMYD3PYGLKMT2ACYP51A1 |
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 |