Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 9/20 | 0.66 |
| ▸ | MEN1 | O00255 | 8/20 | 0.66 |
| ▸ | MAPT | P10636 | 8/20 | 0.66 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.66 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | LMNA | P02545 | 3/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6679220 | 0.93 | ALDH1A1 (0.64) | ALDH1A1KMT2AMEN1MAPTMCL1 | |
| SCHEMBL6671742 | 0.89 | ALDH1A1 (0.66) | ALDH1A1KMT2AMEN1MAPTMCL1 | |
| SCHEMBL6703356 | 0.86 | ALDH1A1 (0.57) | ALDH1A1KMT2AMEN1MAPTMCL1 | |
| SCHEMBL6680623 | 0.85 | ALDH1A1 (0.61) | ALDH1A1KMT2AMEN1MAPTMCL1 | |
| SCHEMBL6670526 | 0.85 | ALDH1A1 (0.70) | ALDH1A1KMT2AMEN1MAPTMCL1 | |
| SCHEMBL6688421 | 0.84 | ALDH1A1 (0.70) | ALDH1A1KMT2AMEN1MAPTMCL1 | |
| SCHEMBL6671130 | 0.84 | ALDH1A1 (0.61) | ALDH1A1KMT2AMEN1MAPTMCL1 | |
| SCHEMBL6678011 | 0.83 | ALDH1A1 (0.55) | ALDH1A1KMT2AMEN1MAPTMCL1 | |
| SCHEMBL6672036 | 0.83 | ALDH1A1 (0.64) | ALDH1A1KMT2AMEN1MAPTMCL1 | |
| SCHEMBL6677563 | 0.82 | ALDH1A1 (0.71) | ALDH1A1KMT2AMEN1MAPTMCL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004043951-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS | CAREX S.A. (FR) | 2004-05-27 | — | — | WO | claimed |
| WO-2004043951-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS | CAREX S.A. (FR) | 2004-05-27 | — | — | WO | disclosed |