Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.61 |
| ▸ | CES2 | O00748 | 1/20 | 0.61 |
| ▸ | GABBR2 | O75899 | 4/20 | 0.55 |
| ▸ | GABBR1 | Q9UBS5 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | EGFR | P00533 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
| ▸ | JAK1 | P23458 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29645049 | 1.00 | CES1 (0.61) | CES1CES2GABBR2GABBR1KDM4E | |
| SCHEMBL29137246 | 0.86 | CES2 (0.59) | CES1CES2GABBR2GABBR1KDM4E | |
| SCHEMBL29439374 | 0.85 | CES2 (0.57) | CES1CES2GABBR2GABBR1KDM4E | |
| SCHEMBL9691247 | 0.85 | CES2 (0.57) | CES1CES2GABBR2GABBR1KDM4E | |
| SCHEMBL16158158 | 0.82 | CES2 (0.53) | CES1CES2GABBR2GABBR1KDM4E | |
| SCHEMBL18936130 | 0.82 | CES2 (0.57) | CES1CES2GABBR2GABBR1KDM4E | |
| SCHEMBL758629 | 0.81 | CES2 (0.57) | CES1CES2GABBR2GABBR1KDM4E | |
| Beta-Naphtoic Acid SCHEMBL30260090 | 0.81 | PTPN1 (0.57) | CES1CES2GABBR2GABBR1KDM4E | |
| SCHEMBL12616469 | 0.80 | CES2 (0.52) | CES1CES2GABBR2GABBR1KDM4E | |
| SCHEMBL855617 | 0.80 | CES2 (0.61) | CES1CES2GABBR2GABBR1KDM4E |
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-106045836-A | Method for synthesizing aromatic hydrocarbon or heterocyclic trifluoromethylketone under catalytic action of copper | 福州大学 | 2016-10-26 | — | — | CN | disclosed |
| WO-2016100555-A1 | BORONIC ACID DERIVATIVES AND USES THEREOF | INCEPTION 4, INC. (US) | 2016-06-23 | — | — | WO | disclosed |
| US-20090317917-A1 | Biosensor and Method for Detecting Analytes | MICRONAS GMBH (DE) | 2009-12-24 | — | — | US | disclosed |
| EP-1410030-A1 | BIOSENSOR AND METHOD FOR DETECTING ANALYTES BY MEANS OF TIME-RESOLVED LUMINESCENCE | Micronas GmbH (DE) | 2004-04-21 | — | — | EP | disclosed |
| WO-2003008974-A1 | BIOSENSOR AND METHOD FOR DETECTING ANALYTES BY MEANS OF TIME-RESOLVED LUMINESCENCE | MICRONAS GMBH (DE) | 2003-01-30 | — | — | WO | disclosed |
| US-5045093-A | Gas separating membranes from polyimide polymers and a process for using the same | AIR PRODUCTS AND CHEMICALS, INC. (US) | 1991-09-03 | — | — | US | disclosed |