Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14033834 | 0.89 | SMN1; SMN2 (0.50) | ALDH1A1TP53SMN1; SMN2GAAMAPT | |
| SCHEMBL9370493 | 0.89 | SMN1; SMN2 (0.47) | ALDH1A1TP53SMN1; SMN2GAAMAPT | |
| SCHEMBL27272041 | 0.86 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2GAAMAPTPOLB | |
| SCHEMBL13629959 | 0.85 | SMN1; SMN2 (0.50) | ALDH1A1TP53SMN1; SMN2GAAMAPT | |
| SCHEMBL14639021 | 0.85 | ALDH1A1 (0.55) | ALDH1A1TP53SMN1; SMN2GAAMAPT | |
| SCHEMBL8140909 | 0.85 | ALDH1A1 (0.49) | ALDH1A1TP53SMN1; SMN2GAAMAPT | |
| Hydrochloric Acid SCHEMBL1371669 | 0.84 | ALDH1A1 (0.54) | ALDH1A1TP53SMN1; SMN2GAAMAPT | |
| SCHEMBL18465656 | 0.84 | ALDH1A1 (0.54) | ALDH1A1TP53SMN1; SMN2GAAMAPT | |
| SCHEMBL5482515 | 0.82 | SMN1; SMN2 (0.46) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL11981721 | 0.81 | SMN1; SMN2 (0.42) | ALDH1A1SMN1; SMN2GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-1068571-A | The 3-amino quinine ring that replaces | PFIZER (US) | 1993-02-03 | — | — | CN | disclosed |