Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.42 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2804456 | 0.92 | SMN1; SMN2 (0.47) | ALDH1A1SMN1; SMN2GMNNLMNACYP2D6 | |
| SCHEMBL10881654 | 0.87 | HPGD (0.49) | ALDH1A1GAASMN1; SMN2LMNAL3MBTL1 | |
| SCHEMBL78451 | 0.85 | KDM4E (0.46) | ALDH1A1GAASMN1; SMN2MAPTTSHR | |
| SCHEMBL11750668 | 0.84 | SMN1; SMN2 (0.47) | ALDH1A1GAASMN1; SMN2LMNAMAPT | |
| SCHEMBL13562561 | 0.84 | KMT2A (0.56) | ALDH1A1GAASMN1; SMN2LMNAMAPT | |
| Ammonia Solution, Strong SCHEMBL28490308 | 0.83 | KDM4E (0.44) | ALDH1A1GAASMN1; SMN2MAPTTSHR | |
| Hydrochloric Acid SCHEMBL28957289 | 0.83 | KDM4E (0.48) | ALDH1A1GAASMN1; SMN2LMNAMAPT | |
| Bromide SCHEMBL11628834 | 0.83 | KDM4E (0.44) | ALDH1A1GAASMN1; SMN2MAPTTSHR | |
| SCHEMBL11797772 | 0.83 | SMN1; SMN2 (0.41) | ALDH1A1SMN1; SMN2GMNNLMNACYP2D6 | |
| SCHEMBL9125852 | 0.83 | TP53 (0.51) | ALDH1A1LMNATSHRL3MBTL1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-3993619-A | AZO DYES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-11-23 | — | — | US | disclosed |