Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 8/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23768908 | 0.73 | UPP1 (0.35) | ALDH1A1KDM4EMAPTKMT2ALMNA | |
| SCHEMBL28205931 | 0.71 | TYR (0.38) | HPGDHTTNPSR1RAB9AMAPK1 | |
| SCHEMBL29269047 | 0.68 | RECQL (0.38) | HPGDMAPK1ALDH1A1KDM4ELMNA | |
| SCHEMBL7213742 | 0.68 | ALDH1A1 (0.38) | HPGDHTTNPSR1RAB9AMAPK1 | |
| SCHEMBL26601811 | 0.68 | HPGD (0.40) | HPGDHTTNPSR1RAB9AMAPK1 | |
| SCHEMBL8321298 | 0.67 | KDM4E (0.45) | HPGDHTTNPSR1RAB9AMAPK1 | |
| SCHEMBL3654974 | 0.67 | MAPT (0.48) | HPGDNPSR1MAPK1ALDH1A1KDM4E | |
| SCHEMBL5379432 | 0.66 | CDK4 (0.33) | MAPK1ALDH1A1KDM4EMAPTKMT2A | |
| SCHEMBL27733897 | 0.66 | ALDH1A1 (0.42) | HPGDHTTNPSR1RAB9AMAPK1 | |
| SCHEMBL11705233 | 0.65 | KCNH2 (0.40) | HPGDNPSR1KDM4EMAPTGAA |
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-2023205463-A1 | HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-10-26 | — | — | WO | disclosed |