Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 7/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6964932 | 0.88 | TDP1 (0.31) | — | |
| SCHEMBL27383900 | 0.81 | ALDH1A1 (0.39) | ALDH1A1ATMTSHRHPGDLMNA | |
| SCHEMBL6965596 | 0.80 | ALDH1A1 (0.38) | ALDH1A1ATMTSHRHPGDLMNA | |
| SCHEMBL6969888 | 0.79 | — | — | |
| SCHEMBL6875291 | 0.74 | ALDH1A1 (0.44) | ALDH1A1ATMTSHRHPGDLMNA | |
| SCHEMBL9628641 | 0.71 | ALDH1A1 (0.43) | ALDH1A1ATMTSHRHPGDLMNA | |
| SCHEMBL10804132 | 0.71 | TSHR (0.39) | ALDH1A1ATMTSHRCYP2C19CYP3A4 | |
| SCHEMBL29282672 | 0.70 | TSHR (0.42) | ALDH1A1TSHRCYP3A4 | |
| SCHEMBL11128347 | 0.69 | ALDH1A1 (0.41) | ALDH1A1ATMTSHRHPGDLMNA | |
| SCHEMBL10835763 | 0.69 | ALDH1A1 (0.52) | ALDH1A1ATMTSHRHPGDLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1329160-A2 | 4-ACYLAMINOPYRAZOLE DERIVATIVES | Sankyo Company, Limited (JP) | 2003-07-23 | — | — | EP | disclosed |