Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19086956 | 0.81 | LMNA (0.68) | ALDH1A1KDM4EPKMSMN1; SMN2RAB9A | |
| SCHEMBL19086973 | 0.75 | MAPK1 (0.51) | ALDH1A1KDM4EPKMSMN1; SMN2LMNA | |
| SCHEMBL15650578 | 0.73 | RAB9A (0.42) | ALDH1A1KDM4EPKMSMN1; SMN2RAB9A | |
| SCHEMBL14096869 | 0.73 | LMNA (0.41) | ALDH1A1KDM4EPKMSMN1; SMN2RAB9A | |
| SCHEMBL31052692 | 0.71 | KDM4E (0.45) | ALDH1A1KDM4EPKMSMN1; SMN2LMNA | |
| SCHEMBL1393649 | 0.70 | — | — | |
| SCHEMBL2428069 | 0.69 | GLS (0.41) | ALDH1A1KDM4EPKMLMNACYP1A2 | |
| SCHEMBL19086810 | 0.69 | KDM4E (0.50) | ALDH1A1KDM4EPKMRAB9AGAA | |
| SCHEMBL23467588 | 0.69 | ALDH1A1 (0.50) | ALDH1A1KDM4EPKMSMN1; SMN2RAB9A | |
| SCHEMBL21825761 | 0.68 | GAA (0.49) | ALDH1A1RAB9ALMNAGAAPOLB |
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-2999338-B1 | KNOWN AND NOVEL HETEROCYCLIC COMPOUNDS AS PESTICIDES | BAYER CROPSCIENCE AG (DE) | 2017-07-12 | — | — | EP | disclosed |