Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | NAMPT | P43490 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RAF1 | P04049 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23320512 | 0.78 | NAMPT (0.74) | ALDH1A1NAMPTROCK2ROCK1 | |
| SCHEMBL23320477 | 0.76 | NAMPT (0.60) | ALDH1A1NAMPTKMT2AMEN1ROCK2 | |
| SCHEMBL11615932 | 0.73 | HSD17B10 (0.79) | ALDH1A1TSHRNAMPTKMT2AHSD17B10 | |
| SCHEMBL23320400 | 0.72 | NAMPT (0.66) | ALDH1A1TSHRNAMPTKMT2AHSD17B10 | |
| Formamide SCHEMBL23320348 | 0.72 | NAMPT (0.48) | ALDH1A1TSHRNAMPTKMT2AHSD17B10 | |
| SCHEMBL22672604 | 0.70 | TBK1 (0.44) | ALDH1A1LMNAHIF1AGAACYP1A2 | |
| Formamide SCHEMBL23320517 | 0.69 | NAMPT (0.45) | ALDH1A1TSHRNAMPTKMT2AHSD17B10 | |
| SCHEMBL4519247 | 0.69 | HSD17B10 (0.70) | ALDH1A1TSHRNAMPTHSD17B10MTOR | |
| SCHEMBL4531077 | 0.69 | HSD17B10 (0.70) | ALDH1A1TSHRNAMPTHSD17B10MTOR | |
| SCHEMBL11615821 | 0.69 | NAMPT (0.64) | ALDH1A1TSHRNAMPTKMT2AHSD17B10 |
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-3818053-A1 | FUSED RING COMPOUND HAVING UREA STRUCTURE | Sanford Burnham Prebys Medical Discovery Institute (US) | 2021-05-12 | — | — | EP | disclosed |