Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.70 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.70 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | FDPS | P14324 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9194705 | 0.86 | CYP2C19 (0.52) | CYP1A2CYP2C9CYP2C19ESR1ESR2 | |
| SCHEMBL9394918 | 0.84 | CYP2C9 (0.50) | CYP1A2CYP2C9CYP2C19ESR1ESR2 | |
| SCHEMBL7266181 | 0.84 | CYP1A2 (0.76) | CYP1A2CYP2C9CYP2C19KCNA5SLC6A2 | |
| SCHEMBL28624141 | 0.83 | CYP2C9 (1.00) | CYP1A2CYP2C9CYP2C19KCNA5SLC6A2 | |
| SCHEMBL23014014 | 0.82 | CYP2C19 (0.48) | CYP1A2CYP2C9CYP2C19ESR1ESR2 | |
| SCHEMBL28309319 | 0.80 | CYP1A2 (0.63) | CYP1A2CYP2C9CYP2C19TAAR1LMNA | |
| SCHEMBL11331380 | 0.80 | CYP2C19 (0.47) | CYP1A2CYP2C9CYP2C19ESR1ESR2 | |
| SCHEMBL14038639 | 0.78 | CYP2C19 (0.45) | CYP1A2CYP2C9CYP2C19LMNAALDH1A1 | |
| SCHEMBL2065092 | 0.78 | TAAR1 (0.47) | CYP1A2CYP2C9CYP2C19TAAR1LMNA | |
| SCHEMBL2065923 | 0.78 | TAAR1 (0.47) | CYP1A2CYP2C9CYP2C19TAAR1LMNA |
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-2250156-A1 | PYRAZINONE DERIVATIVES AS INSULIN SECRETION STIMULATORS, METHODS FOR OBTAINING THEM AND USE THEREOF FOR THE TREATMENT OF DIABETES | Merck Patent GmbH (DE) | 2010-11-17 | — | — | EP | disclosed |
| WO-2009109259-A1 | PYRAZINONE DERIVATIVES AS INSULIN SECRETION STIMULATORS, METHODS FOR OBTAINING THEM AND USE THEREOF FOR THE TREATMENT OF DIABETES | MERCK PATENT GMBH (DE) | 2009-09-11 | — | — | WO | disclosed |