Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | CASP4 | P49662 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | CASP9 | P55211 | 1/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8085338 | 0.87 | KMT2A (0.38) | MEN1KMT2ACASP1CASP3CASP4 | |
| SCHEMBL8089644 | 0.78 | MEN1 (0.34) | MEN1KMT2ACASP1CASP3CASP4 | |
| SCHEMBL8085257 | 0.78 | MEN1 (0.34) | MEN1KMT2ACASP1CASP3CASP4 | |
| SCHEMBL8088704 | 0.76 | ABCC9 (0.40) | MEN1KMT2ATDP1MALT1MAPK1 | |
| SCHEMBL8084409 | 0.75 | ALDH1A1 (0.35) | MEN1KMT2ACASP1CASP3CASP4 | |
| SCHEMBL8076960 | 0.75 | MEN1 (0.37) | MEN1KMT2ACASP1CASP3CASP4 | |
| SCHEMBL8085331 | 0.75 | HSD17B10 (0.38) | MEN1KMT2ACASP1CASP3CASP4 | |
| SCHEMBL8090699 | 0.73 | ALDH1A1 (0.37) | MEN1KMT2ACASP1CASP3CASP4 | |
| SCHEMBL7291279 | 0.73 | ADORA2B (0.31) | MEN1KMT2AADORA2BALDH1A1 | |
| SCHEMBL8085035 | 0.72 | ALDH1A1 (0.38) | MEN1KMT2ACASP1CASP3CASP4 |
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-6040308-A | Chroman derivatives | MERCK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2000-03-21 | — | — | US | disclosed |