Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.69 |
| ▸ | NPC1 | O15118 | 7/20 | 0.66 |
| ▸ | RAB9A | P51151 | 7/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.55 |
| ▸ | RELA | Q04206 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | JAK2 | O60674 | 1/20 | 0.51 |
| ▸ | TNF | P01375 | 1/20 | 0.51 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL27628518 | 0.91 | NPC1 (0.71) | HTTNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL23795778 | 0.91 | NPC1 (0.71) | HTTNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL6536680 | 0.83 | NPC1 (0.67) | HTTNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL17204100 | 0.82 | NPC1 (0.63) | HTTNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2493802 | 0.81 | HTT (1.00) | HTTNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL13750837 | 0.81 | HTT (0.59) | HTTNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL20355764 | 0.81 | NPC1 (0.76) | HTTNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2453899 | 0.81 | NPC1 (0.59) | HTTNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL16388469 | 0.81 | NPC1 (0.60) | HTTNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL14000279 | 0.79 | SLC2A1 (0.60) | HTTNPC1RAB9ASMN1; SMN2ALDH1A1 |
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-2018122775-A1 | HETEROARYL COMPOUNDS AND THEIR USE | MINORYX THERAPEUTICS S.L. (ES) | 2018-07-05 | — | — | WO | disclosed |