Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | UTS2R | Q9UKP6 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1742950 | 0.85 | CES2 (0.37) | CES2CES1PDPK1UTS2RGSK3B | |
| SCHEMBL2544467 | 0.85 | CES2 (0.37) | CES2CES1PDPK1UTS2RGSK3B | |
| SCHEMBL1742949 | 0.85 | CES2 (0.37) | CES2CES1PDPK1UTS2RGSK3B | |
| SCHEMBL2548060 | 0.84 | AKR1C3 (0.37) | CES2CES1PDPK1CYP3A4UTS2R | |
| SCHEMBL1595216 | 0.84 | AKR1C3 (0.37) | CES2CES1PDPK1CYP3A4UTS2R | |
| SCHEMBL1595011 | 0.82 | AKR1C3 (0.40) | CES2CES1FFAR1AKR1C3AKR1C2 | |
| SCHEMBL1595880 | 0.79 | AKR1C3 (0.39) | CES2CES1PPARGPPARACYP3A4 | |
| SCHEMBL1594707 | 0.77 | FFAR1 (0.34) | CES2CES1PPARGUTS2RFFAR1 | |
| SCHEMBL1743844 | 0.77 | FFAR1 (0.34) | CES2CES1PPARGUTS2RFFAR1 | |
| SCHEMBL2549587 | 0.77 | FFAR1 (0.34) | CES2CES1PPARGUTS2RFFAR1 |
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-7919504-B2 | Thiadiazole modulators of PKB | AMGEN INC. (US) | 2011-04-05 | — | — | US | disclosed |