Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | BTK | Q06187 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HTR5A | P47898 | 1/20 | 0.30 |
| ▸ | GBA1 | P04062 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15034179 | 0.82 | CHRM2 (0.37) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 | |
| SCHEMBL11914063 | 0.79 | CHRM2 (0.34) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 | |
| SCHEMBL28200005 | 0.73 | KEAP1 (0.41) | ALDH1A1NPC1KDM4EFEN1L3MBTL1 | |
| SCHEMBL22843160 | 0.72 | L3MBTL1 (0.36) | CHRM3ALDH1A1NPC1RAB9ALMNA | |
| SCHEMBL24007544 | 0.71 | CHRM2 (0.33) | CHRM2CHRM4CHRM5CHRM3PTGER4 | |
| SCHEMBL22792309 | 0.71 | CHRM2 (0.36) | CHRM2CHRM4CHRM5CHRM3FEN1 | |
| SCHEMBL24299650 | 0.69 | IRAK4 (0.41) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 | |
| SCHEMBL24915274 | 0.68 | KDM4E (0.42) | ALDH1A1KDM4EUSP2MEN1KMT2A | |
| SCHEMBL21940456 | 0.67 | CHRM2 (0.33) | CHRM2CHRM4CHRM5CHRM3L3MBTL1 | |
| SCHEMBL15847313 | 0.66 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1MEN1KMT2A |
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-9676759-B2 | Isoindolinone inhibitors of phosphatidylinositol 3-kinase | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2017-06-13 | — | — | US | disclosed |