Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IAPP | P10997 | 4/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.45 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.45 |
| ▸ | ALB | P02768 | 1/20 | 0.43 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8388641 | 0.84 | RIPK1 (0.48) | IAPPGABRA1GABRB2RIPK1CES2 | |
| SCHEMBL8676972 | 0.83 | ALDH1A1 (0.46) | RIPK1ALDH1A1MAPK1CXCL8 | |
| SCHEMBL28357376 | 0.81 | ANO1 (0.47) | IAPPGABRA1GABRB2ANO1ALB | |
| SCHEMBL3988403 | 0.81 | GABRA1 (0.70) | IAPPGABRA1GABRB2ANO1ALB | |
| SCHEMBL6035567 | 0.79 | AKR1B1 (0.55) | ANO1ALBERN1HMGB1CXCL8 | |
| SCHEMBL27991359 | 0.79 | MEP1B (0.39) | IAPPGABRA1GABRB2ANO1RIPK1 | |
| SCHEMBL21438272 | 0.78 | NLRP3 (0.49) | GABRA1GABRB2ANO1ALDH1A1 | |
| SCHEMBL16396591 | 0.77 | ANO1 (0.47) | GABRA1GABRB2ANO1ALBALDH1A1 | |
| SCHEMBL21100152 | 0.76 | IAPP (0.46) | IAPPGABRA1GABRB2ALDH1A1CES2 | |
| SCHEMBL28840672 | 0.76 | ALOX5 (0.55) | IAPPGABRA1GABRB2ANO1ERN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104326919-A | Compound 2-hydroxy-3-fluoro-5-nitro-1-phenyl butanone and preparation method and agricultural biological activity thereof | UNIV QINGDAO AGRICULTURAL | 2015-02-04 | — | — | CN | claimed |
| CN-104326919-A | Compound 2-hydroxy-3-fluoro-5-nitro-1-phenyl butanone and preparation method and agricultural biological activity thereof | UNIV QINGDAO AGRICULTURAL | 2015-02-04 | — | — | CN | disclosed |
| CN-104326919-A | Compound 2-hydroxy-3-fluoro-5-nitro-1-phenyl butanone and preparation method and agricultural biological activity thereof | UNIV QINGDAO AGRICULTURAL | 2015-02-04 | — | — | CN | disclosed |