Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | CDC25A | P30304 | 6/20 | 0.45 |
| ▸ | CDC25B | P30305 | 6/20 | 0.45 |
| ▸ | CDC25C | P30307 | 5/20 | 0.45 |
| ▸ | MITF | O75030 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.43 |
| ▸ | SCD | O00767 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGAV | P06756 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6407880 | 0.94 | PPARA (0.46) | PPARACDC25ACDC25BCDC25CMITF | |
| SCHEMBL7953979 | 0.92 | ALDH1A1 (0.50) | PPARATSHRSCDITGB3ITGAV | |
| SCHEMBL7953996 | 0.86 | ALDH1A1 (0.44) | PPARACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL11340693 | 0.78 | CHRM2 (0.41) | PPARACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL25209625 | 0.78 | CHRM2 (0.43) | PPARACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL20020301 | 0.78 | ALDH1A1 (0.42) | PPARAMITFTP53NCOA3LMNA | |
| SCHEMBL4674145 | 0.77 | TSHR (0.51) | MITFTP53NCOA3LMNAATM | |
| SCHEMBL23588114 | 0.77 | CHRM2 (0.44) | PPARACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL25296172 | 0.77 | CHRM2 (0.44) | PPARACHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL23588152 | 0.77 | CHRM2 (0.44) | PPARACHRM2CHRM4CHRM5CHRM1 |
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-6329389-B1 | HETEROCYCLIC AMINES AND DERIVATIVES, SOMATOSTATIN AND ANTIDIABETIC AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-12-11 | — | — | US | disclosed |