Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GALR3 | O60755 | 2/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL9480352 | 0.79 | MEN1 (0.31) | ALDH1A1LMNAHSD17B10MEN1KMT2A | |
| SCHEMBL9444050 | 0.77 | ALDH1A1 (0.34) | ALDH1A1LMNAHSD17B10MEN1KMT2A | |
| SCHEMBL9475522 | 0.75 | TSHR (0.32) | TSHR | |
| SCHEMBL17401241 | 0.72 | ALDH1A1 (0.48) | ALDH1A1LMNAHSD17B10MEN1KMT2A | |
| SCHEMBL608761 | 0.72 | — | — | |
| SCHEMBL17401270 | 0.69 | ALDH1A1 (0.50) | ALDH1A1LMNAHSD17B10GALR3CHRM5 | |
| SCHEMBL17401240 | 0.69 | ALDH1A1 (0.43) | ALDH1A1LMNAHSD17B10MEN1KMT2A | |
| SCHEMBL6247833 | 0.69 | — | — | |
| SCHEMBL28975645 | 0.67 | — | — | |
| Ethyl Acetate SCHEMBL29187192 | 0.67 | ALDH1A1 (0.70) | ALDH1A1LMNAHSD17B10MEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5186770-A | Bis(2-nitro-2-azapropyl) ether | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1993-02-16 | — | — | US | claimed |
| US-5186770-A | Bis(2-nitro-2-azapropyl) ether | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1993-02-16 | — | — | US | disclosed |
| US-5186770-A | Bis(2-nitro-2-azapropyl) ether | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1993-02-16 | — | — | US | disclosed |
| US-4567296-A | 1-Fluoro-1,1,5-trinitro-3-oxa-5-azahexane and method of preparation | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1986-01-28 | — | — | US | disclosed |