Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ALDH1A3 | P47895 | 3/20 | 0.43 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.36 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.34 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5776983 | 0.82 | ALDH1A1 (0.33) | ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A | |
| SCHEMBL5912958 | 0.81 | NR3C1 (0.39) | ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A | |
| SCHEMBL31107315 | 0.81 | PYCR1 (0.51) | ALDH1A1MEN1KMT2AERCC1ERCC4 | |
| SCHEMBL5779948 | 0.79 | ALDH1A1 (0.33) | ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A | |
| SCHEMBL28546904 | 0.78 | EPHX2 (0.44) | ALDH1A1HSP90AA1MEN1KMT2AERCC1 | |
| SCHEMBL1935709 | 0.75 | RAB9A (0.47) | ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A | |
| SCHEMBL5110282 | 0.75 | HTT (0.50) | ALDH1A1 | |
| SCHEMBL6015146 | 0.75 | ALDH1A1 (0.59) | ALDH1A1ALDH1A3ALDH3A1NR3C1PGR | |
| SCHEMBL27848038 | 0.74 | ALDH1A3 (0.54) | ALDH1A1ALDH1A3ALDH3A1NR3C1PGR | |
| SCHEMBL5912961 | 0.73 | ALDH1A3 (0.42) | ALDH1A1ALDH1A3ALDH3A1MEN1KMT2A |
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-1612204-A1 | HYDRAZONE DERIVATIVE | DAIICHI PHARMACEUTICAL CO., LTD. (JP) | 2006-01-04 | — | — | EP | disclosed |