Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.56 |
| ▸ | MEN1 | O00255 | 5/20 | 0.56 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2562342 | 0.89 | ALDH1A1 (0.53) | KMT2AMEN1PDE4DALDH1A1TSHR | |
| SCHEMBL2553897 | 0.87 | MEN1 (0.58) | KMT2AMEN1PDE4DALDH1A1TSHR | |
| SCHEMBL2555825 | 0.85 | PDE4D (0.63) | PDE4DALDH1A1TSHRTP53ALOX12 | |
| SCHEMBL2560207 | 0.84 | MEN1 (0.40) | KMT2AMEN1PDE4DALDH1A1CYP3A4 | |
| SCHEMBL2563418 | 0.80 | CYP2C9 (0.56) | KMT2AMEN1PDE4DALDH1A1TSHR | |
| SCHEMBL2560863 | 0.79 | ALDH1A1 (0.55) | KMT2AMEN1ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL6264973 | 0.79 | PDE4D (0.73) | KMT2AMEN1PDE4DALDH1A1TP53 | |
| SCHEMBL2557760 | 0.78 | MEN1 (0.48) | KMT2AMEN1ALDH1A1TP53KDM4E | |
| SCHEMBL2557580 | 0.78 | KMT2A (0.48) | KMT2AMEN1ALDH1A1TSHRTP53 | |
| SCHEMBL2563146 | 0.78 | ALDH1A1 (0.52) | KMT2APDE4DALDH1A1TSHRTP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2552895-B1 | PYRAZOLE SYNTHESIS BY COUPLING OF CARBOXYLIC ACID DERIVATIVES AND ENAMINES | Westfälische Wilhelms Universität Münster (DE) | 2015-02-25 | — | — | EP | disclosed |
| EP-2552895-A1 | PYRAZOLE SYNTHESIS BY COUPLING OF CARBOXYLIC ACID DERIVATIVES AND ENAMINES | Westfälische Wilhelms-Universität Münster (DE) | 2013-02-06 | — | — | EP | disclosed |
| WO-2011120861-A1 | PYRAZOLE SYNTHESIS BY COUPLING OF CARBOXYLIC ACID DERIVATIVES AND ENAMINES | WESTFÄLISHE WILHELMS-UNIVERSITÄT MÜNSTER (DE) | 2011-10-06 | — | — | WO | disclosed |