Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of 2-Ethylhexanoic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.91 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.91 |
| ▸ | CA1 | P00915 | 4/20 | 0.59 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.57 |
| ▸ | SLC1A1 | P43005 | 3/20 | 0.57 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.57 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.52 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | HTR2C | P28335 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | HRH1 | P35367 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.50 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| 2-Ethylhexanoic Acid SCHEMBL15390846 | 0.98 | CA2 (0.95) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL133703 | 0.98 | CA2 (0.95) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL28232467 | 0.98 | CA2 (0.95) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL29627551 | 0.98 | CA2 (0.95) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL27844757 | 0.95 | CA2 (0.91) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL27872148 | 0.95 | CA2 (0.91) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL9737644 | 0.95 | CA2 (0.91) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL7156446 | 0.95 | CA2 (0.91) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL5695779 | 0.95 | CA2 (1.00) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL5512393 | 0.95 | CA2 (1.00) | CA2MAPK1CA1SLC1A2SLC1A1 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230226807-A1 | Polymer Composites and Methods of Making the Same | TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION | 2023-07-20 | — | — | US | disclosed |
| WO-2021226424-A1 | POLYMER COMPOSITES AND METHODS OF MAKING THE SAME | TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2021-11-11 | — | — | WO | disclosed |
| EP-3436537-B1 | ANAEROBICALLY CURABLE (METH)ACRYLATE COMPOSITIONS | Henkel IP & Holding GmbH (DE) | 2021-09-29 | — | — | EP | disclosed |
| US-11111416-B2 | Anaerobically curable (meth)acrylate compositions | Henkel IP & Holding GmbH (DE) | 2021-09-07 | — | — | US | disclosed |
| EP-3402855-B1 | CURE OF ANAEROBIC COMPOSITIONS | Henkel IP & Holding GmbH (DE) | 2021-07-14 | — | — | EP | disclosed |
| WO-2020229096-A1 | METHOD FOR BONDING THREE-DIMENSIONAL ARTICLES MADE BY ADDITIVE MANUFACTURING | Henkel IP & Holding GmbH (DE) | 2020-11-19 | — | — | WO | disclosed |
| US-10414948-B2 | Cure of anaerobic compositions | Henkel IP & Holding GmbH (DE) | 2019-09-17 | — | — | US | disclosed |
| EP-3436537-A1 | ANAEROBICALLY CURABLE (METH)ACRYLATE COMPOSITIONS | Henkel IP & Holding GmbH (DE) | 2019-02-06 | — | — | EP | disclosed |
| US-20190031921-A1 | ANAEROBICALLY CURABLE (METH)ACRYLATE COMPOSITIONS | HENKEL AG & CO. KGAA (DE) | 2019-01-31 | — | — | US | disclosed |
| EP-3402855-A1 | CURE OF ANAEROBIC COMPOSITIONS | Henkel IP & Holding GmbH (DE) | 2018-11-21 | — | — | EP | disclosed |
| US-20180320027-A1 | CURE OF ANAEROBIC COMPOSITIONS | HENKEL AG & CO. KGAA (DE) | 2018-11-08 | — | — | US | disclosed |
| WO-2017168001-A1 | ANAEROBICALLY CURABLE (METH)ACRYLATE COMPOSITIONS | Henkel IP & Holding GmbH (DE) | 2017-10-05 | — | — | WO | disclosed |
| WO-2017121824-A1 | CURE OF ANAEROBIC COMPOSITIONS | Henkel IP & Holding GmbH (DE) | 2017-07-20 | — | — | WO | disclosed |