Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.37 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.37 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 3/20 | 0.37 |
| ▸ | BCHE | P06276 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL720121 | 0.87 | GCG (0.42) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL718505 | 0.80 | NPC1 (0.42) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL717861 | 0.80 | NPC1 (0.39) | NPC1RAB9AALDH1A1MTNR1AMTNR1B | |
| SCHEMBL3402110 | 0.79 | CNR1 (0.39) | NPC1RAB9AKMT2APTGS1PTGS2 | |
| SCHEMBL718588 | 0.78 | MEN1 (0.43) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL718278 | 0.77 | NPC1 (0.43) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL720117 | 0.77 | KMT2A (0.38) | NPC1RAB9AKMT2AMEN1ALDH1A1 | |
| SCHEMBL721161 | 0.76 | NPC1 (0.50) | NPC1RAB9AALDH1A1POLB | |
| SCHEMBL719515 | 0.75 | NPC1 (0.43) | NPC1RAB9AALDH1A1MTNR1AMTNR1B | |
| SCHEMBL718887 | 0.73 | CNR2 (0.37) | NPC1RAB9AALDH1A1 |
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-2251326-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2010-11-17 | — | — | EP | disclosed |