Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPI | P34949 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8469643 | 0.98 | MPI (0.35) | MPICYP1A2SMN1; SMN2CYP2D6PKM | |
| SCHEMBL2781260 | 0.94 | MPI (0.37) | MPICYP1A2SMN1; SMN2CYP2D6PKM | |
| SCHEMBL3327489 | 0.84 | MPI (0.32) | MPI | |
| SCHEMBL624112 | 0.82 | MPI (0.37) | MPI | |
| SCHEMBL419463 | 0.82 | MPI (0.37) | MPI | |
| Bicarbonate SCHEMBL8384988 | 0.81 | MPI (0.36) | MPI | |
| SCHEMBL426315 | 0.81 | MPI (0.36) | MPISMN1; SMN2LMNA | |
| SCHEMBL2354360 | 0.81 | MPI (0.36) | MPI | |
| SCHEMBL215097 | 0.81 | MPI (0.36) | MPISMN1; SMN2LMNA | |
| SCHEMBL2884877 | 0.81 | MPI (0.36) | MPISMN1; SMN2LMNA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2616434-A1 | PRODRUGS OF GUANFACINE | Shire LLC (US) | 2013-07-24 | — | — | EP | claimed |
| WO-2012035346-A1 | PRODRUGS OF GUANFACINE | SHIRE, LLC (US) | 2012-03-22 | — | — | WO | claimed |
| EP-2616434-A1 | PRODRUGS OF GUANFACINE | Shire LLC (US) | 2013-07-24 | — | — | EP | disclosed |
| WO-2012035346-A1 | PRODRUGS OF GUANFACINE | SHIRE, LLC (US) | 2012-03-22 | — | — | WO | disclosed |
| US-20050107602-A1 | Method for producing cellulose carbamate | FRAUNHOFER-GESELLSCHAFT ZUR FOERDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) | 2005-05-19 | — | — | US | disclosed |