Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.40 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | FYN | P06241 | 2/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.38 |
| ▸ | CSNK1E | P49674 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL13498819 | 0.80 | MAP3K5 (0.52) | ADORA3ADORA1POLBMAPTNPC1 | |
| Formic Acid SCHEMBL3485941 | 0.77 | MAP3K5 (0.48) | ADORA3ADORA1POLBMAPTNPC1 | |
| SCHEMBL3091747 | 0.63 | PIK3CG (0.63) | ADORA3ADORA1PIK3CG | |
| SCHEMBL13498813 | 0.62 | MAP3K5 (0.56) | ADORA3MAPTCSNK1DCSNK1E | |
| SCHEMBL3485946 | 0.62 | ALDH1A1 (0.46) | ADORA3ADORA1POLBMAPTNPC1 | |
| SCHEMBL3486280 | 0.61 | MAP3K5 (0.67) | POLBMAPTLMNACSNK1DCSNK1E | |
| SCHEMBL13498806 | 0.60 | MAP3K5 (0.57) | CSNK1DCSNK1E | |
| SCHEMBL13498805 | 0.60 | MAP3K5 (0.56) | CSNK1DCSNK1ERIPK1 | |
| SCHEMBL3487219 | 0.60 | CSNK1D (0.56) | CSNK1DCSNK1E | |
| SCHEMBL12664264 | 0.59 | CSNK1D (0.52) | CSNK1DCSNK1ERIPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2058309-A1 | FUSED HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2009-05-13 | — | — | EP | disclosed |