Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.39 |
| ▸ | RIPK2 | O43353 | 14/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.35 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LYN | P07948 | 3/20 | 0.33 |
| ▸ | LCK | P06239 | 2/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.33 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24393296 | 0.84 | NRAS (0.39) | PIK3CAMTORRIPK2ALDH1A1LYN | |
| SCHEMBL19781567 | 0.82 | PIK3CA (0.38) | PIK3CAMTORRIPK2AXLLYN | |
| SCHEMBL19781784 | 0.79 | TRPA1 (0.34) | KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL25383907 | 0.78 | RIPK2 (0.38) | PIK3CAMTORRIPK2SUV39H2 | |
| SCHEMBL25384458 | 0.78 | PRKDC (0.39) | PIK3CAMTORRIPK2LYNSUV39H2 | |
| SCHEMBL31356618 | 0.78 | RIPK2 (0.38) | PIK3CAMTORRIPK2AXLLYN | |
| SCHEMBL20985980 | 0.77 | TGFBR1 (0.34) | KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL24975882 | 0.75 | RIPK2 (0.39) | RIPK2LYNLCK | |
| SCHEMBL31356594 | 0.75 | RIPK2 (0.36) | PIK3CAMTORRIPK2AXLLYN | |
| SCHEMBL25148947 | 0.74 | POLB (0.40) | RIPK2KDM4ELYNLCK |
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-2022108849-A1 | HETEROCYCLIC COMPOUNDS AS THERAPEUTIC AGENTS | ARISAN THERAPEUTICS INC. (US) | 2022-05-27 | — | — | WO | disclosed |