Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Isoetharine. 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 | |
|---|---|---|---|---|
| ▸ | ADRB2 known ✓ | P07550 | 8/20 | 1.00 |
| ▸ | PTGS2 | P35354 | 3/20 | 1.00 |
| ▸ | OPRK1 | P41145 | 1/20 | 1.00 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 1.00 |
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.86 |
| ▸ | MAPT | P10636 | 8/20 | 0.86 |
| ▸ | TSHR | P16473 | 6/20 | 0.86 |
| ▸ | HIF1A | Q16665 | 5/20 | 0.86 |
| ▸ | LMNA | P02545 | 5/20 | 0.86 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.86 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.86 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.86 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.86 |
| ▸ | BLM | P54132 | 3/20 | 0.86 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.86 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.86 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.86 |
| ▸ | THPO | P40225 | 2/20 | 0.86 |
| ▸ | GAA | P10253 | 2/20 | 0.86 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.86 |
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 | |
|---|---|---|---|---|
| Isoetharine SCHEMBL3225540 | 1.00 | ADRB2 (1.00) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| Isoetharine SCHEMBL56515 | 1.00 | ADRB2 (1.00) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| Isoetharine SCHEMBL3218412 | 1.00 | ADRB2 (1.00) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| Isoetharine SCHEMBL21252711 | 1.00 | ADRB2 (1.00) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| Isoetharine SCHEMBL56516 | 1.00 | ADRB2 (1.00) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| Isoetharine SCHEMBL211343 | 0.98 | ADRB2 (0.97) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| Isoetharine SCHEMBL2407556 | 0.93 | KDM4E (1.00) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| Isoetharine SCHEMBL29380912 | 0.93 | KDM4E (1.00) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| Isoetharine SCHEMBL212005 | 0.93 | KDM4E (1.00) | ADRB2PTGS2OPRK1SLC6A3KDM4E | |
| Isoetharine SCHEMBL4377543 | 0.92 | KDM4E (0.97) | ADRB2PTGS2OPRK1SLC6A3KDM4E |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2025103215-A1 | FOUR-MEMBERED-RING AMIDE COMPOUNDS AND USE THEREOF | 青岛清原化合物有限公司 | 2025-05-22 | — | — | WO | disclosed |
| CN-119907790-A | Pyrazole amide insecticidal agents | FMC公司 | 2025-04-29 | — | — | CN | disclosed |
| WO-2025056007-A1 | FOUR-MEMBERED RING AMIDE COMPOUNDS AND USE THEREOF | 青岛清原化合物有限公司 | 2025-03-20 | — | — | WO | disclosed |
| US-20250084220-A1 | LIGNIN HYBRID POLYMERS OBTAINED FROM THE REACTION OF LIGNIN AND COMPATIBLE POLYMER PRECURSORS, AND STARTING COMPOSITIONS FOR FORMING LIGNIN HYBRID POLYMERS | Organic Chemical, LLC | 2025-03-13 | — | — | US | disclosed |
| WO-2025026292-A1 | 4-MEMBERED CYCLIC AMIDE COMPOUND AND USE THEREOF | 青岛清原化合物有限公司 | 2025-02-06 | — | — | WO | disclosed |
| CN-118209655-A | Method for detecting ergot alkaloid in food | 安徽省疾病预防控制中心(省健康教育所、省公共卫生研究院) | 2024-06-18 | — | — | CN | disclosed |
| CN-111497821-B | Energy management method for hybrid vehicle | 北京汽车股份有限公司 | 2022-03-25 | — | — | CN | disclosed |