Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27751424 | 0.86 | AAK1 (0.42) | AAK1POLBKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL323430 | 0.75 | AAK1 (0.38) | AAK1POLBKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL22322065 | 0.74 | HSD17B10 (0.39) | AAK1POLBKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL18348265 | 0.73 | AAK1 (0.38) | AAK1POLBSMN1; SMN2MEN1KMT2A | |
| SCHEMBL1404066 | 0.72 | AAK1 (0.42) | AAK1POLBKDM4ESMN1; SMN2PKM | |
| SCHEMBL361806 | 0.72 | KDM4E (0.47) | POLBKDM4EALDH1A1SMN1; SMN2HCAR2 | |
| SCHEMBL1588556 | 0.71 | ACACB (0.39) | AAK1LMNACNR2 | |
| SCHEMBL12702282 | 0.71 | ACACB (0.39) | AAK1LMNACNR2 | |
| SCHEMBL1588323 | 0.71 | ACACB (0.39) | AAK1LMNACNR2 | |
| SCHEMBL9862013 | 0.71 | SSTR4 (0.41) | POLBKDM4EALDH1A1SMN1; SMN2HCAR2 |
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-2552918-B1 | N-(IMIDAZOPYRIMIDIN-7-YL)-HETEROARYLAMIDE DERIVATIVES AND THEIR USE AS PDE10A INHIBITORS | HOFFMANN LA ROCHE (CH) | 2014-06-11 | — | — | EP | claimed |