Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | KDM4A | O75164 | 2/20 | 0.43 |
| ▸ | KDM5A | P29375 | 2/20 | 0.43 |
| ▸ | PPARD | Q03181 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 5/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9823633 | 0.85 | EPHX1 (0.43) | EPHX1KDM4AKDM5APPARDPPARA | |
| SCHEMBL10223956 | 0.82 | EPHX1 (0.43) | EPHX1KDM4AKDM5APPARDPPARA | |
| SCHEMBL20350712 | 0.78 | KDM4A (0.44) | EPHX1KDM4AKDM5APPARDPPARA | |
| SCHEMBL20697803 | 0.78 | TSHR (0.49) | EPHX1KDM4AKDM5ATRPV1ENPP2 | |
| SCHEMBL30791533 | 0.78 | TSHR (0.49) | EPHX1KDM4AKDM5ATRPV1ENPP2 | |
| SCHEMBL19815542 | 0.77 | PPARA (0.41) | PPARDPPARA | |
| SCHEMBL9823992 | 0.77 | KDM4A (0.38) | EPHX1KDM4AKDM5ANOTUMENPP2 | |
| SCHEMBL30791540 | 0.77 | ENPP2 (0.46) | EPHX1KDM4AKDM5ANOTUMTRPV1 | |
| SCHEMBL31285901 | 0.77 | CA2 (0.50) | EPHX1KDM4AKDM5APPARDALDH1A1 | |
| SCHEMBL15206175 | 0.77 | CA2 (0.50) | EPHX1KDM4AKDM5APPARDALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0301393-B1 | 1,4-DISUBSTITUTED 1-AZOLYL-3,3-DYMETHYLBUTANE DERIVATIVES | BAYER AG (DE) | 1991-08-14 | — | — | EP | disclosed |
| US-4968712-A | PHYTOPATHOGENS, AGRICULTURE | BAYER AKTIENGESELLSCHAFT (DE) | 1990-11-06 | — | — | US | disclosed |
| EP-0301393-A1 | 1,4-Disubstituted 1-azolyl-3,3-dymethylbutane derivatives | BAYER AG (DE) | 1989-02-01 | — | — | EP | disclosed |