Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | APLNR | P35414 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | TYR | P14679 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2477285 | 1.00 | ALDH1A1 (0.35) | ALDH1A1GLAAPLNRTP53TSHR | |
| SCHEMBL2476778 | 0.89 | ALDH1A1 (0.35) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL2475856 | 0.84 | ALDH1A1 (0.36) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL10151075 | 0.84 | ALDH1A1 (0.36) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL10165731 | 0.83 | ALDH1A1 (0.33) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL17226978 | 0.83 | PKM (0.41) | ALDH1A1GLAAPLNRTP53TSHR | |
| SCHEMBL12203805 | 0.83 | ALDH1A1 (0.35) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL6741725 | 0.83 | ALDH1A1 (0.33) | ALDH1A1GLATP53TSHRHIF1A | |
| SCHEMBL6796536 | 0.83 | PKM (0.41) | ALDH1A1GLAAPLNRTP53TSHR | |
| SCHEMBL6742164 | 0.83 | ALDH1A1 (0.32) | ALDH1A1GLATP53TSHRHIF1A |
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-2374794-A1 | CYCLIC AMINE COMPOUNDS | Daiichi Sankyo Company, Limited (JP) | 2011-10-12 | — | — | EP | disclosed |