Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
| ▸ | DPP4 | P27487 | 1/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | ABL1 | P00519 | 2/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | BCR | P11274 | 2/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.37 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL9722543 | 0.85 | DPP4 (0.59) | HSD11B1DPP4NR1H4PDE10AAKT1 | |
| SCHEMBL12969932 | 0.84 | DPP4 (0.46) | DPP4NR1H4PDE10AAKT1CYP17A1 | |
| SCHEMBL27249844 | 0.83 | PDE10A (0.50) | DPP4PDE10ACYP17A1ALDH1A1KDM4E | |
| SCHEMBL12970089 | 0.82 | DPP4 (0.41) | DPP4NR1H4PDE10AAKT1CYP17A1 | |
| SCHEMBL12970323 | 0.81 | NR1H4 (0.46) | HSD11B1NR1H4ESR1ESR2CYP17A1 | |
| SCHEMBL12970326 | 0.80 | NR1H4 (0.45) | HSD11B1DPP4NR1H4ESR1ESR2 | |
| SCHEMBL12970322 | 0.80 | NR1H4 (0.40) | HSD11B1NR1H4ESR1ESR2ABL1 | |
| SCHEMBL12970428 | 0.80 | HSD17B1 (0.41) | DPP4NR1H4ESR1ESR2CYP17A1 | |
| SCHEMBL13137273 | 0.79 | DPP4 (0.47) | HSD11B1DPP4AKT1ESR1ESR2 | |
| SCHEMBL27249454 | 0.78 | CYP17A1 (0.47) | DPP4PDE10ACYP17A1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012133607-A1 | PYRAZOLE COMPOUND | アステラス製薬株式会社 (JP) | 2012-10-04 | — | — | WO | disclosed |