Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 9/20 | 0.44 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 2/20 | 0.42 |
| ▸ | CASP2 | P42575 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28677862 | 1.00 | TSHR (0.46) | TSHREPHX1ZDHHC7FAAHCASP2 | |
| SCHEMBL5123880 | 1.00 | TSHR (0.46) | TSHREPHX1ZDHHC7FAAHCASP2 | |
| SCHEMBL28364726 | 1.00 | TSHR (0.46) | TSHREPHX1ZDHHC7FAAHCASP2 | |
| SCHEMBL11194460 | 1.00 | TSHR (0.46) | TSHREPHX1ZDHHC7FAAHCASP2 | |
| SCHEMBL11184643 | 0.98 | TSHR (0.43) | TSHREPHX1ZDHHC7FAAHCASP2 | |
| SCHEMBL2504071 | 0.94 | SMN1; SMN2 (0.41) | TSHREPHX1ZDHHC7KMT2ALMNA | |
| SCHEMBL5011365 | 0.92 | ACHE (0.42) | TSHRZDHHC7FAAHMEN1KMT2A | |
| SCHEMBL28250638 | 0.92 | ACHE (0.42) | TSHRZDHHC7FAAHMEN1KMT2A | |
| SCHEMBL2504506 | 0.92 | SMN1; SMN2 (0.41) | TSHRKMT2ALMNA | |
| SCHEMBL29211218 | 0.87 | EPHX1 (0.50) | TSHREPHX1FAAH |
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 |
|---|---|---|---|---|---|---|---|
| EP-3104833-B1 | CAPRYLOYL ALANINE ETHYL ESTER AS A PENETRATION ENHANCEER | BASF SE (DE) | 2018-01-03 | — | — | EP | disclosed |
| US-20160367457-A1 | CAPRYLOYL ALANINE ETHYLESTER AS A PENETRATION ENHANCER | BASF FRANCE S.A.S. (FR) | 2016-12-22 | — | — | US | disclosed |
| EP-3104833-A1 | CAPRYLOYL ALANINE ETHYLESTER AS A PENETRATION ENHANCEER | BASF SE (DE) | 2016-12-21 | — | — | EP | disclosed |
| WO-2015121102-A1 | CAPRYLOYL ALANINE ETHYLESTER AS A PENETRATION ENHANCEER | BASF SE (DE) | 2015-08-20 | — | — | WO | disclosed |