Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6339852 | 0.93 | ALDH1A1 (0.38) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL3459348 | 0.93 | KMT2A (0.42) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL3459350 | 0.93 | KMT2A (0.42) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL3458728 | 0.92 | ALDH1A1 (0.41) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL3458727 | 0.92 | ALDH1A1 (0.41) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL3458729 | 0.92 | ALDH1A1 (0.41) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL7547077 | 0.90 | ALDH1A1 (0.40) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL6341635 | 0.88 | SMN1; SMN2 (0.35) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL6343215 | 0.88 | GABRA1 (0.38) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL6341939 | 0.88 | CYP1A2 (0.36) | ALDH1A1KMT2AMEN1MAPTLMNA |
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 |