Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | AOC2 | O75106 | 1/20 | 0.51 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MPO | P05164 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | KDM5A | P29375 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1445203 | 1.00 | ALDH1A1 (0.59) | ALDH1A1KDM4EAOC2ENPP2RAB9A | |
| Hydrochloric Acid SCHEMBL4551090 | 0.98 | ALDH1A1 (0.58) | ALDH1A1KDM4EAOC2ENPP2RAB9A | |
| SCHEMBL4396938 | 0.83 | HDAC6 (0.61) | KDM4EENPP2CA1HDAC1HDAC6 | |
| SCHEMBL77384 | 0.82 | ALDH1A1 (0.76) | ALDH1A1KDM4EAOC2RAB9ANPC1 | |
| SCHEMBL190230 | 0.81 | HDAC6 (0.59) | ALDH1A1KDM4EENPP2MEN1KMT2A | |
| SCHEMBL3031782 | 0.81 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2MEN1GAAKMT2A | |
| SCHEMBL3756621 | 0.81 | ENPP2 (0.47) | ALDH1A1KDM4EENPP2RAB9ANPC1 | |
| SCHEMBL3449695 | 0.80 | KMT2A (0.44) | ALDH1A1KDM4EENPP2RAB9ANPC1 | |
| SCHEMBL5083356 | 0.80 | HPGD (0.51) | ALDH1A1KDM4EENPP2SMN1; SMN2HTT | |
| SCHEMBL30047181 | 0.79 | PARP1 (0.59) | ALDH1A1KDM4EENPP2CYP3A4BLM |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |