Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Hexadecyl Dihydrogen Phosphate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR3 | Q9UBY5 | 14/20 | 0.84 |
| ▸ | LPAR2 | Q9HBW0 | 10/20 | 0.84 |
| ▸ | LPAR1 | Q92633 | 7/20 | 0.84 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Phosphoric Acid Monotetradecyl Ester SCHEMBL28595278 | 0.98 | LPAR3 (0.88) | LPAR3LPAR2LPAR1LPAR5CYP3A4 | |
| Phosphoric Acid Monododecyl Ester SCHEMBL28901475 | 0.98 | LPAR3 (0.88) | LPAR3LPAR2LPAR1LPAR5CYP3A4 | |
| Trimethylammonium SCHEMBL27625006 | 0.98 | LPAR3 (0.88) | LPAR3LPAR2LPAR1LPAR5CYP3A4 | |
| Trimethylammonium SCHEMBL9189106 | 0.98 | LPAR3 (0.88) | LPAR3LPAR2LPAR1LPAR5CYP3A4 | |
| Hexadecyl Dihydrogen Phosphate SCHEMBL2809430 | 0.98 | LPAR3 (0.88) | LPAR3LPAR2LPAR1LPAR5CYP3A4 | |
| Trimethylammonium SCHEMBL28027117 | 0.98 | LPAR3 (0.88) | LPAR3LPAR2LPAR1LPAR5CYP3A4 | |
| Phosphoric Acid Monododecyl Ester SCHEMBL28901478 | 0.98 | LPAR3 (0.88) | LPAR3LPAR2LPAR1LPAR5CYP3A4 | |
| Phosphoric Acid Monododecyl Ester SCHEMBL27830856 | 0.96 | LPAR3 (0.84) | LPAR3LPAR2LPAR1LPAR5CYP3A4 | |
| Hexadecyl Dihydrogen Phosphate SCHEMBL27679691 | 0.96 | LPAR3 (0.84) | LPAR3LPAR2LPAR1LPAR5CYP3A4 | |
| SCHEMBL28467135 | 0.94 | LPAR3 (0.95) | LPAR3LPAR2LPAR1LPAR5CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107982236-A | A kind of felodipine sustained-release tablets | 西南医科大学 | 2018-05-04 | — | — | CN | disclosed |
| CN-107875132-A | A kind of felodipine sustained-release preparation composition and preparation method thereof | 常州市第四制药厂有限公司 | 2018-04-06 | — | — | CN | disclosed |