Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | KDM5C | P41229 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.35 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | ECE1 | P42892 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGAV | P06756 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4223239 | 0.83 | SMN1; SMN2 (0.46) | KDM4EKDM5CEGLN1PHF8KDM2A | |
| SCHEMBL1935273 | 0.80 | ALDH1A1 (0.39) | KDM4EKDM5CEGLN1PHF8KDM2A | |
| SCHEMBL9731666 | 0.78 | ADRA1A (0.45) | ADRA1AKDM4EMAPK1HIF1AALDH1A1 | |
| SCHEMBL4229696 | 0.78 | CYP2D6 (0.39) | KDM4EKDM5CEGLN1PHF8KDM2A | |
| SCHEMBL3711344 | 0.78 | CYP2C19 (0.38) | KDM4EKDM5CEGLN1PHF8KDM2A | |
| SCHEMBL6940463 | 0.77 | CYP2C19 (0.36) | ADRA1AKDM4EMAPK1HIF1AKMT2A | |
| SCHEMBL15055415 | 0.75 | KDM4E (0.33) | KDM4EKDM5CEGLN1PHF8KDM2A | |
| SCHEMBL4040747 | 0.75 | LMNA (0.46) | ADRA1AKDM4EKDM5CEGLN1PHF8 | |
| SCHEMBL6894584 | 0.74 | — | — | |
| SCHEMBL12155314 | 0.74 | KMT2A (0.53) | ADRA1AKDM4EMAPTKMT2AALDH1A1 |
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-3116316-B1 | HEPATITIS B CORE PROTEIN ALLOSTERIC MODULATORS | UNIV INDIANA RES & TECH CORP (US) | 2019-07-10 | — | — | EP | disclosed |