Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.51 |
| ▸ | GAA | P10253 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.42 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21799422 | 0.87 | IRAK4 (0.50) | ALDH1A1GAAMAPTL3MBTL1POLB | |
| SCHEMBL14821628 | 0.84 | ALDH1A1 (0.69) | ALDH1A1GAAMAPTL3MBTL1POLB | |
| SCHEMBL19019655 | 0.83 | ALDH1A1 (0.53) | ALDH1A1GAAMAPTL3MBTL1POLB | |
| SCHEMBL10267021 | 0.80 | NPC1 (0.42) | ALDH1A1GAAL3MBTL1NPC1RAB9A | |
| SCHEMBL19019666 | 0.80 | NPC1 (0.74) | ALDH1A1MAPTPOLBNPC1RAB9A | |
| SCHEMBL23234411 | 0.77 | CYP17A1 (0.40) | ALDH1A1L3MBTL1NPC1RAB9AKDM4E | |
| SCHEMBL30754181 | 0.77 | CYP17A1 (0.40) | ALDH1A1L3MBTL1NPC1RAB9AKDM4E | |
| SCHEMBL10290923 | 0.77 | KMT2A (0.48) | ALDH1A1MAPTPOLBNPC1RAB9A | |
| Hydrochloric Acid SCHEMBL518722 | 0.76 | KMT2A (0.47) | ALDH1A1GAAMAPTPOLBNPC1 | |
| SCHEMBL21799396 | 0.75 | SGMS2 (0.49) | ALDH1A1HPGDKMT2AHTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-107001383-B | Oxygen azatropylidene compound and contain the compound as the insecticide for agricultural or horticultural use of effective component and its application method | 日本农药株式会社 | 2019-07-26 | — | — | CN | disclosed |