Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.57 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | NAMPT | P43490 | 1/20 | 0.53 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.51 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4122852 | 0.86 | MAPT (0.68) | NPC1RAB9AHTTLMNAMEN1 | |
| SCHEMBL13210705 | 0.85 | NAMPT (0.66) | NR1H4MAPK14NPC1RAB9ANAMPT | |
| SCHEMBL666216 | 0.83 | MAPK14 (0.74) | NR1H4MAPK14NPC1RAB9AMEN1 | |
| SCHEMBL15788186 | 0.81 | MAPK14 (0.66) | NR1H4MAPK14NPC1RAB9ANAMPT | |
| SCHEMBL2173418 | 0.80 | HTT (0.71) | NR1H4NPC1RAB9ANAMPTHTT | |
| SCHEMBL7300564 | 0.79 | NR1H4 (0.80) | NR1H4MAPK14NPC1RAB9ANAMPT | |
| SCHEMBL94618 | 0.79 | NAMPT (0.59) | NR1H4MAPK14NPC1RAB9ANAMPT | |
| SCHEMBL6655548 | 0.79 | KMT2A (0.66) | NR1H4MAPK14NPC1RAB9ANAMPT | |
| SCHEMBL14187585 | 0.78 | PTGS1 (0.62) | NR1H4MAPK14NPC1RAB9ANAMPT | |
| SCHEMBL21237393 | 0.77 | LMNA (0.56) | NR1H4MAPK14NAMPTHTTLMNA |
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-2396307-A1 | NOVEL AMINO AZAHETEROCYCLIC CARBOXAMIDES | Merck Patent GmbH (DE) | 2011-12-21 | — | — | EP | disclosed |
| WO-2010093419-A1 | NOVEL AMINO AZAHETEROCYCLIC CARBOXAMIDES | MERCK PATENT GMBH (DE) | 2010-08-19 | — | — | WO | disclosed |