Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | RARB | P10826 | 6/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | RARA | P10276 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4911541 | 1.00 | NPC1 (0.55) | NPC1NFKB1MAPK1RAB9ANFKB2 | |
| SCHEMBL12439871 | 1.00 | NPC1 (0.55) | NPC1NFKB1MAPK1RAB9ANFKB2 | |
| SCHEMBL10358431 | 0.94 | SMN1; SMN2 (0.51) | NPC1NFKB1MAPK1RAB9ANFKB2 | |
| SCHEMBL753213 | 0.94 | SMN1; SMN2 (0.51) | NPC1NFKB1MAPK1RAB9ANFKB2 | |
| SCHEMBL13475015 | 0.94 | SMN1; SMN2 (0.51) | NPC1NFKB1MAPK1RAB9ANFKB2 | |
| SCHEMBL1046903 | 0.94 | SMN1; SMN2 (0.51) | NPC1NFKB1MAPK1RAB9ANFKB2 | |
| SCHEMBL992778 | 0.94 | SMN1; SMN2 (0.51) | NPC1NFKB1MAPK1RAB9ANFKB2 | |
| SCHEMBL12313750 | 0.94 | SMN1; SMN2 (0.51) | NPC1NFKB1MAPK1RAB9ANFKB2 | |
| SCHEMBL12313746 | 0.94 | SMN1; SMN2 (0.51) | NPC1NFKB1MAPK1RAB9ANFKB2 | |
| SCHEMBL12669128 | 0.94 | NPC1 (0.50) | NPC1NFKB1MAPK1RAB9ANFKB2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7666956-B2 | Polymer | MERCK PATENT GMBH (DE) | 2010-02-23 | — | — | US | disclosed |
| US-7666956-B2 | Polymer | MERCK PATENT GMBH (DE) | 2010-02-23 | — | — | US | disclosed |
| EP-1633801-B1 | Semiconducting polymer | MERCK PATENT GMBH (DE) | 2008-04-09 | — | — | EP | disclosed |