Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 13/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | FABP3 | P05413 | 2/20 | 0.37 |
| ▸ | FABP4 | P15090 | 2/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9861941 | 0.85 | GABRA1 (0.36) | ADRB2GABRA1GABRB2FABP3FABP4 | |
| SCHEMBL14486799 | 0.79 | ADRB2 (0.56) | ADRB2ADRB1TSHR | |
| SCHEMBL19506266 | 0.79 | GABRA1 (0.44) | ADRB2GABRA1ADRB1GLAPOLB | |
| SCHEMBL3440745 | 0.79 | GABRA1 (0.50) | GABRA1GABRB2FABP3FABP4FABP5 | |
| SCHEMBL9861620 | 0.77 | GABRA1 (0.57) | GABRA1GABRB2FABP3FABP4FABP5 | |
| SCHEMBL15934974 | 0.75 | ADRB2 (0.38) | ADRB2GABRA1GABRB2HTR2AHTR2C | |
| SCHEMBL19972016 | 0.75 | GABRA1 (0.43) | GABRA1GABRB2FABP3FABP4FABP5 | |
| SCHEMBL12552644 | 0.74 | HTR2A (0.37) | ADRB2GABRA1GABRB2FABP3FABP4 | |
| SCHEMBL15934961 | 0.73 | HTR2A (0.36) | ADRB2GABRA1GABRB2FABP3FABP4 | |
| SCHEMBL27889312 | 0.73 | GABRA1 (0.45) | GABRA1GABRB2FABP3FABP4FABP5 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5008425-A | Trifluoromethylation of carbonyl compounds | ETHYL CORPORATION (US) | 1991-04-16 | — | — | US | disclosed |
| EP-0336371-A2 | Gem-disubstituted cyclohexadienones and their production | ETHYL CORPORATION (US) | 1989-10-11 | — | — | EP | disclosed |
| US-4845258-A | Production of gem-disubstituted cyclohexadienones | ETHYL CORPORATION (US) | 1989-07-04 | — | — | US | disclosed |
| US-4804774-A | Production of gem-disubstituted cyclohexadienones | ETHYL CORPORATION (US) | 1989-02-14 | — | — | US | disclosed |
| US-4804772-A | Gem-disubstituted cyclohexadienones and their production | ETHYL CORPORATION (US) | 1989-02-14 | — | — | US | disclosed |
| US-4804773-A | Production of gem-disubstituted cyclohexadienones | ETHYL CORPORATION (US) | 1989-02-14 | — | — | US | disclosed |