Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.76 |
| ▸ | CTSD | P07339 | 1/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.64 |
| ▸ | ALPL | P05186 | 2/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.59 |
| ▸ | MAPT | P10636 | 5/20 | 0.59 |
| ▸ | GAA | P10253 | 4/20 | 0.59 |
| ▸ | HTT | P42858 | 3/20 | 0.59 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL31621278 | 0.85 | ALDH1A1 (0.76) | ALDH1A1CTSDTDP1ALPLCYP1A2 | |
| SCHEMBL296470 | 0.85 | ALDH1A1 (0.76) | ALDH1A1CTSDTDP1ALPLCYP1A2 | |
| SCHEMBL16677831 | 0.83 | ALDH1A1 (0.73) | ALDH1A1CTSDTDP1ALPLCYP1A2 | |
| SCHEMBL4694811 | 0.83 | ALDH1A1 (0.73) | ALDH1A1CTSDTDP1ALPLCYP1A2 | |
| SCHEMBL8781857 | 0.83 | ALDH1A1 (0.73) | ALDH1A1CTSDTDP1ALPLCYP1A2 | |
| SCHEMBL962966 | 0.83 | CTSD (1.00) | ALDH1A1CTSDTDP1ALPLCYP1A2 | |
| SCHEMBL417378 | 0.83 | ALDH1A1 (0.73) | ALDH1A1CTSDTDP1ALPLCYP1A2 | |
| SCHEMBL27499127 | 0.82 | ALDH1A1 (0.67) | ALDH1A1CTSDTDP1ALPLCYP1A2 | |
| SCHEMBL8117817 | 0.82 | CTSD (0.68) | ALDH1A1CTSDTDP1ALPLCYP1A2 | |
| SCHEMBL436389 | 0.82 | ALDH1A1 (0.66) | ALDH1A1CTSDTDP1ALPLCYP1A2 |
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 |