Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.62 |
| ▸ | RAB9A | P51151 | 4/20 | 0.62 |
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 2/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL12366171 | 0.81 | ALDH1A1 (0.58) | NPC1RAB9AMAPK1ALDH1A1LMNA | |
| SCHEMBL12366133 | 0.81 | HPGD (0.54) | NPC1RAB9AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL12366090 | 0.81 | ALDH1A1 (0.57) | NPC1RAB9AMEN1KMT2AHTT | |
| SCHEMBL12366181 | 0.81 | KMT2A (0.54) | NPC1RAB9AMEN1KMT2AALDH1A1 | |
| SCHEMBL8740727 | 0.80 | NPC1 (0.70) | NPC1RAB9AMEN1KMT2AHTT | |
| SCHEMBL12366196 | 0.78 | KMT2A (0.58) | MEN1KMT2ASMN1; SMN2HPGDLMNA | |
| SCHEMBL30259918 | 0.78 | HTT (0.71) | NPC1RAB9AMEN1KMT2AHTT | |
| SCHEMBL2910835 | 0.78 | HTT (0.71) | NPC1RAB9AMEN1KMT2AHTT | |
| SCHEMBL7933993 | 0.78 | NPC1 (0.68) | NPC1RAB9AMEN1KMT2AHTT | |
| SCHEMBL28822079 | 0.78 | NPC1 (0.68) | NPC1RAB9AMEN1KMT2AHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-7998986-B2 | Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors | EXELIXIS PATENT COMPANY LLC (US) | 2011-08-16 | — | — | US | disclosed |