Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | PYGL | P06737 | 2/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | ABL1 | P00519 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | PGK1 | P00558 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16044403 | 0.91 | ALDH1A1 (0.38) | ALDH1A1PYGLNQO2SMN1; SMN2KDM4E | |
| SCHEMBL3836847 | 0.89 | ABL1 (0.34) | ALDH1A1PYGLSMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL3333108 | 0.88 | ALDH1A1 (0.38) | ALDH1A1PYGLNQO2SMN1; SMN2KDM4E | |
| SCHEMBL16127200 | 0.88 | ALDH1A1 (0.36) | ALDH1A1NQO2SMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL16095650 | 0.86 | ALDH1A1 (0.38) | ALDH1A1PYGLNQO2SMN1; SMN2KDM4E | |
| SCHEMBL16036011 | 0.86 | ALDH1A1 (0.36) | ALDH1A1NQO2SMN1; SMN2KDM4EABL1 | |
| SCHEMBL29557036 | 0.86 | ALDH1A1 (0.36) | ALDH1A1NQO2SMN1; SMN2KDM4EABL1 | |
| SCHEMBL16035807 | 0.85 | ALDH1A1 (0.36) | ALDH1A1NQO2SMN1; SMN2ABL1NPC1 | |
| SCHEMBL16036003 | 0.85 | ALDH1A1 (0.36) | ALDH1A1NQO2KDM4ENPC1CYP1A2 | |
| SCHEMBL29556783 | 0.85 | ALDH1A1 (0.36) | ALDH1A1NQO2KDM4ENPC1CYP1A2 |
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-2060566-B1 | Poly-substituted aryls | DOW AGROSCIENCES LLC (US) | 2016-06-08 | — | — | EP | disclosed |