Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 6/20 | 0.46 |
| ▸ | TTR | P02766 | 8/20 | 0.43 |
| ▸ | ERN1 | O75460 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.41 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 1/20 | 0.41 |
| ▸ | COMT | P21964 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11808827 | 0.89 | GPR35 (0.56) | GPR35TTRCA12CA1CA2 | |
| SCHEMBL21487096 | 0.89 | TTR (0.47) | GPR35TTRERN1CA12CA1 | |
| SCHEMBL10880580 | 0.86 | TTR (0.57) | GPR35TTRERN1CA12CA1 | |
| SCHEMBL9706244 | 0.84 | TTR (0.62) | GPR35TTRERN1ALDH1A1MAPT | |
| SCHEMBL11802641 | 0.83 | GPR35 (0.47) | GPR35TTRERN1CA12CA1 | |
| SCHEMBL11799144 | 0.80 | GSK3B (0.47) | GPR35TTRERN1CA12CA1 | |
| SCHEMBL11805184 | 0.80 | GSK3B (0.50) | GPR35TTRERN1CA12CA1 | |
| SCHEMBL11806725 | 0.79 | TTR (0.62) | TTRCA1CA2MEN1ALDH1A1 | |
| SCHEMBL443827 | 0.79 | MEN1 (0.51) | GPR35ERN1CA12CA1CA2 | |
| SCHEMBL30153000 | 0.79 | MEN1 (0.51) | GPR35ERN1CA12CA1CA2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3933472-A | Substituted alkylaryl ketones and methods of use as herbicides | BUCKMAN LABORATORIES, INC. (US) | 1976-01-20 | — | — | US | disclosed |