Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 5/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12655605 | 0.76 | NPC1 (0.35) | NPC1GAARAB9AMEN1KMT2A | |
| SCHEMBL12435375 | 0.74 | ESR1 (0.34) | NPC1GAARAB9AMEN1KMT2A | |
| SCHEMBL22812715 | 0.73 | SMN1; SMN2 (0.43) | NPC1GAARAB9AMEN1KMT2A | |
| SCHEMBL15434187 | 0.71 | MEN1 (0.35) | MEN1KMT2A | |
| SCHEMBL21871024 | 0.68 | NPC1 (0.40) | NPC1GAARAB9AMEN1KMT2A | |
| SCHEMBL10073980 | 0.67 | FURIN (0.37) | KDM1ANPC1RAB9AHDAC8 | |
| SCHEMBL12280824 | 0.65 | MEN1 (0.31) | MEN1KMT2A | |
| SCHEMBL24061723 | 0.65 | NFE2L2 (0.38) | NPC1GAARAB9AMEN1KMT2A | |
| SCHEMBL10281027 | 0.65 | AKT1 (0.34) | — | |
| SCHEMBL13461097 | 0.64 | MAPT (0.41) | NPC1GAARAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012110182-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2012-08-23 | — | — | WO | disclosed |