Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.53 |
| ▸ | ABAT | P80404 | 1/20 | 0.53 |
| ▸ | ERN1 | O75460 | 3/20 | 0.49 |
| ▸ | XDH | P47989 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | CTSB | P07858 | 1/20 | 0.47 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16838211 | 0.88 | ERN1 (0.56) | ALDH5A1ABATERN1XDHTP53 | |
| SCHEMBL31448585 | 0.85 | ERN1 (0.53) | ALDH5A1ABATERN1XDHTP53 | |
| SCHEMBL31448565 | 0.85 | ERN1 (0.53) | ALDH5A1ABATERN1XDHTP53 | |
| SCHEMBL16838198 | 0.83 | GPR35 (0.52) | ALDH5A1ABATERN1XDHTP53 | |
| SCHEMBL16838217 | 0.79 | GPR35 (0.52) | ALDH5A1ABATERN1XDHTP53 | |
| SCHEMBL8655232 | 0.78 | ALDH5A1 (0.50) | ALDH5A1ABATERN1XDHTP53 | |
| SCHEMBL15811523 | 0.78 | ALDH5A1 (0.50) | ALDH5A1ABATERN1XDHTP53 | |
| SCHEMBL4888730 | 0.78 | ERN1 (0.57) | ERN1HPGDCYP3A4ALDH1A1ALOX15 | |
| SCHEMBL10501311 | 0.78 | ERN1 (0.57) | ERN1HPGDCYP3A4ALDH1A1ALOX15 | |
| SCHEMBL351534 | 0.77 | GPR35 (0.60) | ALDH5A1ABATERN1TP53HPGD |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110003031-B | Amphiphilic molecule containing o-nitrobenzyl ester photodegradation group and synthetic method thereof | 大连理工大学 | 2020-06-02 | — | — | CN | disclosed |
| US-7718598-B1 | Auxiliary for amide bond formation | THE UNIVERSITY OF QUEENSLAND (AU) | 2010-05-18 | — | — | US | disclosed |
| EP-1115739-B1 | AUXILIARY FOR AMIDE BOND FORMATION | UNIV QUEENSLAND (AU) | 2009-04-29 | — | — | EP | disclosed |
| EP-1115739-A4 | AUXILIARY FOR AMIDE BOND FORMATION | UNIV QUEENSLAND (AU) | 2004-10-27 | — | — | EP | disclosed |
| EP-1115739-A1 | AUXILIARY FOR AMIDE BOND FORMATION | THE UNIVERSITY OF QUEENSLAND (AU) | 2001-07-18 | — | — | EP | disclosed |
| WO-2000018789-A1 | AUXILIARY FOR AMIDE BOND FORMATION | THE UNIVERSITY OF QUEENSLAND (AU) | 2000-04-06 | — | — | WO | disclosed |