Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ERN1 | O75460 | 2/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7541385 | 0.87 | ALDH1A1 (0.44) | PTGDR2KDM4EHPGDERN1LTA4H | |
| SCHEMBL7541400 | 0.86 | PTGDR2 (0.46) | PTGDR2KDM4EERN1KMT2AMEN1 | |
| SCHEMBL5207046 | 0.86 | PTGDR2 (0.39) | PTGDR2KDM4EERN1KMT2ACYP1A2 | |
| SCHEMBL3458964 | 0.83 | ALDH3A1 (0.42) | EGFRPTGDR2KDM4EHPGDERN1 | |
| SCHEMBL5549984 | 0.83 | PTGDR2 (0.45) | PTGDR2KDM4EERN1KMT2AMEN1 | |
| SCHEMBL5551206 | 0.82 | PTGDR2 (0.44) | PTGDR2KDM4EERN1KMT2AMEN1 | |
| SCHEMBL3172718 | 0.81 | PTGDR2 (0.35) | EGFRPTGDR2KDM4EHPGDERN1 | |
| SCHEMBL24662160 | 0.80 | HPGD (0.38) | EGFRKDM4EHPGDLTA4HKMT2A | |
| SCHEMBL6104478 | 0.79 | ERN1 (0.41) | EGFRPTGDR2KDM4EHPGDERN1 | |
| SCHEMBL3458699 | 0.78 | BCHE (0.40) | LTA4HKMT2AMEN1MAPT |
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-1211239-A1 | PROCESS FOR THE PREPARATION OF 2,3-DIHYDROAZEPINE COMPOUNDS | Takeda Chemical Industries, Ltd. (JP) | 2002-06-05 | — | — | EP | disclosed |