Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 5/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | XBP1 | P17861 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | LIPE | Q05469 | 1/20 | 0.41 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL4601371 | 0.89 | HPGD (0.48) | PPARGHPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4601003 | 0.89 | HPGD (0.48) | PPARGHPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4600789 | 0.88 | HPGD (0.48) | PPARGHPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4601556 | 0.86 | HPGD (0.47) | PPARGHPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4601774 | 0.85 | HPGD (0.49) | PPARGHPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4602102 | 0.85 | HPGD (0.49) | PPARGHPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4600147 | 0.84 | HPGD (0.48) | PPARGHPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4601848 | 0.84 | HPGD (0.50) | PPARGHPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4601418 | 0.83 | HPGD (0.51) | PPARGHPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4600376 | 0.82 | HPGD (0.53) | PPARGHPGDCYP1A2CYP3A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1912645-A2 | THERAPEUTIC AGENT FOR DIABETES | Takeda Pharmaceutical Company Limited (JP) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007018314-A2 | THERAPEUTIC AGENT FOR DIABETES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-02-15 | — | — | WO | disclosed |