Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 3/20 | 0.42 |
| ▸ | PPARA | Q07869 | 3/20 | 0.42 |
| ▸ | ACE | P12821 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | MLYCD | O95822 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | CPA1 | P15085 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4462979 | 0.84 | PPARG (0.40) | PPARGPPARAACECYP2C19CES1 | |
| SCHEMBL8314036 | 0.83 | PPARA (0.36) | PPARGPPARAACECHRM2CHRM4 | |
| SCHEMBL8311399 | 0.82 | PPARA (0.37) | PPARGPPARAACECYP2C19CES1 | |
| SCHEMBL7856007 | 0.81 | CPA1 (0.49) | PPARGPPARACHRM2CHRM4CHRM5 | |
| SCHEMBL7856004 | 0.81 | CPA1 (0.49) | PPARGPPARACHRM2CHRM4CHRM5 | |
| SCHEMBL6372914 | 0.77 | PPARA (0.47) | PPARGPPARAACE | |
| SCHEMBL8310840 | 0.76 | PPARA (0.42) | PPARGPPARAACECYP2C19PPARD | |
| SCHEMBL8310839 | 0.74 | ACE (0.42) | PPARGPPARAACECYP2C19 | |
| SCHEMBL3582904 | 0.72 | HTR5A (0.36) | PPARGPPARAACECYP2C19MLYCD | |
| SCHEMBL9551283 | 0.71 | CYP1A2 (0.46) | CYP2C19CPA1RIPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5684137-A | TECHNETIUM AND RHENIUM LABELS FOR LIGANDS AND PROTEINS | NEORX CORPORATION (US) | 1997-11-04 | — | — | US | disclosed |
| US-5616579-A | ADMINISTERING TO MAMMALS TO PREVENT GASTRIC ULCER | SANKYO COMPANY, LIMITED (JP) | 1997-04-01 | — | — | US | disclosed |