Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 4/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | NT5E | P21589 | 1/20 | 0.33 |
| ▸ | TTK | P33981 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 5/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.32 |
| ▸ | USP2 | O75604 | 3/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4909130 | 0.73 | — | — | |
| SCHEMBL19439 | 0.73 | NOTUM (0.39) | MEN1CYP1A2CYP3A4KMT2AALOX15 | |
| SCHEMBL5797199 | 0.71 | MAPT (0.43) | TTKCYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL1521945 | 0.68 | IMPDH2 (0.37) | FYNTDO2TTKADORA2AMEN1 | |
| SCHEMBL4489657 | 0.68 | CYP2A6 (0.56) | MEN1CYP1A2CYP3A4CYP2C19CYP2D6 | |
| SCHEMBL4590846 | 0.68 | MAPK14 (0.35) | TDO2KMT2AMAPTALDH1A1 | |
| SCHEMBL2412002 | 0.68 | NOTUM (0.39) | TDO2CYP1A2KMT2AKDM4E | |
| SCHEMBL9199874 | 0.68 | SCN9A (0.33) | — | |
| SCHEMBL6188099 | 0.67 | NOTUM (0.37) | — | |
| SCHEMBL450165 | 0.67 | ALDH1A1 (0.43) | MEN1KMT2AUSP2MAPTKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107382996-B | Specific inhibition plant plasma membrane H+-ATPase compound and preparation method and application thereof | 中国农业大学 | 2020-11-06 | — | — | CN | disclosed |
| US-6063956-A | APPLYING FUNGICIDE OR INSECTICIDE TO THE LOCUS WHERE CONTROL IS DESIRED | ROHM AND HAAS COMPANY (US) | 2000-05-16 | — | — | US | disclosed |