Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 5/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.44 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.41 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | KMO | O15229 | 2/20 | 0.40 |
| ▸ | FABP4 | P15090 | 1/20 | 0.39 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | KAT6A | Q92794 | 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 | |
|---|---|---|---|---|
| SCHEMBL2824930 | 0.85 | SLC6A9 (0.59) | SLC6A9S1PR3KCNH2BRD4 | |
| SCHEMBL5045383 | 0.82 | BRD4 (0.48) | SLC6A9S1PR3APEX1KCNH2SYK | |
| SCHEMBL5043166 | 0.82 | S1PR3 (0.45) | SLC6A9S1PR3APEX1KCNH2SYK | |
| SCHEMBL1813202 | 0.81 | SLC6A9 (0.54) | SLC6A9S1PR3KCNH2BRD4 | |
| SCHEMBL5043148 | 0.80 | MAPK1 (0.49) | SLC6A9S1PR3SYK | |
| SCHEMBL20476411 | 0.80 | XDH (0.46) | SLC6A9S1PR3 | |
| SCHEMBL5041677 | 0.78 | FABP4 (0.45) | SLC6A9S1PR3APEX1SYKFABP4 | |
| SCHEMBL17027246 | 0.77 | PTGDR2 (0.50) | PIM1PIM2APEX1SYKKMO | |
| SCHEMBL5041907 | 0.77 | PDE4A (0.42) | SLC6A9MRGPRX1APEX1SYKFABP4 | |
| SCHEMBL4422191 | 0.77 | APEX1 (0.44) | SLC6A9S1PR3MRGPRX1APEX1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1656361-B1 | PIPERAZINE WITH OR-SUBSTITUTED PHENYL GROUP AND THEIR USE AS GLYT1 INHIBITORS | HOFFMANN LA ROCHE (CH) | 2008-01-02 | — | — | EP | disclosed |