Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.34 |
| ▸ | SIK2 | Q9H0K1 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.33 |
| ▸ | WDR5 | P61964 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.32 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.32 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.32 |
| ▸ | NCSTN | Q92542 | 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 | |
|---|---|---|---|---|
| SCHEMBL12004118 | 0.94 | PIK3CG (0.37) | PIK3CGSIK2HTR2AGRM2ENPP2 | |
| SCHEMBL1819817 | 0.92 | HDAC4 (0.40) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL1817522 | 0.86 | P2RX7 (0.38) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL1817822 | 0.84 | PIK3CG (0.34) | PIK3CGHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1814937 | 0.80 | HDAC1 (0.39) | HDAC3HDAC4HDAC1HDAC7HDAC8 | |
| SCHEMBL1815573 | 0.80 | GRM2 (0.39) | PIK3CGHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1819026 | 0.80 | PSEN1 (0.42) | HDAC4HDAC1HRH3ENPP2KCNH2 | |
| SCHEMBL12019483 | 0.79 | ENPP2 (0.37) | PIK3CGHTR2AGRM2ENPP2KCNH2 | |
| SCHEMBL1819583 | 0.79 | PIK3CG (0.40) | PIK3CGHTR2AGRM2ENPP2 | |
| SCHEMBL1819582 | 0.79 | PIK3CG (0.40) | PIK3CGHTR2AGRM2ENPP2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2496569-A2 | HETEROCYCLIC DERIVATIVES | MSD Oss B.V. (NL) | 2012-09-12 | — | — | EP | disclosed |
| WO-2011051490-A2 | HETEROCYCLIC DERIVATIVES | N.V. ORGANON (NL) | 2011-05-05 | — | — | WO | disclosed |