Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 9/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GSR | P00390 | 2/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9332607 | 0.81 | KDM4E (0.43) | EPHX1BCHEPOLBGSRSIGMAR1 | |
| SCHEMBL9333251 | 0.79 | BCHE (0.38) | EPHX1BCHEPOLBGSREPHX2 | |
| SCHEMBL9345071 | 0.78 | POLB (0.65) | EPHX1BCHEPOLBGSREPHX2 | |
| Bicarbonate SCHEMBL10444461 | 0.78 | GSR (0.52) | EPHX1BCHEPOLBGSRRAB9A | |
| SCHEMBL379250 | 0.76 | EPHX1 (0.70) | EPHX1POLBCHRM5CHRM3SIGMAR1 | |
| SCHEMBL9344976 | 0.75 | EPHX1 (0.43) | EPHX1BCHEPOLBCHRM5CHRM3 | |
| Cyclohexanol SCHEMBL9330386 | 0.75 | EPHX1 (0.61) | EPHX1POLBCHRM5CHRM3SIGMAR1 | |
| Hydrochloric Acid SCHEMBL15546957 | 0.74 | EPHX1 (0.67) | EPHX1POLBCHRM5CHRM3SIGMAR1 | |
| SCHEMBL9332479 | 0.74 | GSR (0.41) | GSRMAPTALDH1A1CYP3A4 | |
| SCHEMBL1774751 | 0.74 | GSR (0.54) | EPHX1BCHEPOLBGSRRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0366004-B1 | Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof | BOEHRINGER MANNHEIM GMBH (DE) | 1994-03-30 | — | — | EP | disclosed |
| EP-0366004-A1 | Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof | Roche Diagnostics GmbH (DE) | 1990-05-02 | — | — | EP | disclosed |