Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR1 | Q92633 | 7/20 | 0.70 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.60 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.60 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | MGLL | Q99685 | 1/20 | 0.54 |
| ▸ | CNR2 | P34972 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | DGKA | P23743 | 1/20 | 0.50 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11293636 | 1.00 | LPAR1 (0.70) | LPAR1ADRB2ADRB1ADRB3KDM4E | |
| SCHEMBL1983179 | 0.94 | ADRB2 (0.66) | LPAR1ADRB2ADRB1ADRB3KDM4E | |
| Phenylbutanoic Acid SCHEMBL406962 | 0.90 | ADRB2 (0.62) | LPAR1ADRB2ADRB1ADRB3KDM4E | |
| Phenylbutanoic Acid SCHEMBL28794522 | 0.87 | HDAC3 (0.61) | LPAR1ADRB2ADRB1ADRB3KDM4E | |
| SCHEMBL9463643 | 0.86 | LPAR1 (0.71) | LPAR1ADRB2ADRB1ADRB3KMT2A | |
| SCHEMBL11877761 | 0.81 | KMT2A (0.55) | LPAR1ADRB2ADRB1ADRB3KDM4E | |
| SCHEMBL8332902 | 0.81 | LMNA (0.82) | LPAR1KDM4EDUSP3MEN1KMT2A | |
| SCHEMBL839526 | 0.81 | LMNA (0.82) | LPAR1KDM4EDUSP3MEN1KMT2A | |
| SCHEMBL20624 | 0.81 | LMNA (0.82) | LPAR1KDM4EDUSP3MEN1KMT2A | |
| SCHEMBL380177 | 0.81 | LMNA (0.82) | LPAR1KDM4EDUSP3MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-116332765-B | Alkanoate compound and preparation method and application thereof | 江西省药品检验检测研究院 | 2023-08-04 | — | — | CN | claimed |
| CN-116332765-A | Alkanoate compound and preparation method and application thereof | 江西省药品检验检测研究院 | 2023-06-27 | — | — | CN | claimed |
| CN-116332765-B | Alkanoate compound and preparation method and application thereof | 江西省药品检验检测研究院 | 2023-08-04 | — | — | CN | disclosed |
| CN-116332765-A | Alkanoate compound and preparation method and application thereof | 江西省药品检验检测研究院 | 2023-06-27 | — | — | CN | disclosed |