Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 5/20 | 0.56 |
| ▸ | PDK1 | Q15118 | 4/20 | 0.52 |
| ▸ | TTR | P02766 | 4/20 | 0.48 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.46 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.39 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.39 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.39 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 1/20 | 0.39 |
| ▸ | COMT | P21964 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11796921 | 0.90 | PDK1 (0.58) | GPR35PDK1TTRVCAM1 | |
| SCHEMBL4901895 | 0.81 | GPR35 (0.61) | GPR35TTRVCAM1ABCC3ABCC4 | |
| SCHEMBL3770749 | 0.81 | TTR (0.62) | GPR35TTRVCAM1ALDH1A1 | |
| SCHEMBL11800419 | 0.80 | TTR (0.58) | PDK1TTRALDH1A1CYP3A4 | |
| SCHEMBL11802620 | 0.80 | GPR35 (0.59) | GPR35TTRVCAM1ABCC3ABCC4 | |
| SCHEMBL11800920 | 0.79 | PDK1 (0.51) | PDK1VCAM1PDK3PDK4ALDH1A1 | |
| Potassium Ion SCHEMBL11799623 | 0.79 | GPR35 (0.57) | GPR35TTRVCAM1ABCC3ABCC4 | |
| Potassium SCHEMBL11799629 | 0.79 | GPR35 (0.57) | GPR35TTRVCAM1ABCC3ABCC4 | |
| SCHEMBL11799616 | 0.79 | GPR35 (0.57) | GPR35TTRVCAM1ABCC3ABCC4 | |
| SCHEMBL11801800 | 0.77 | GPR35 (0.56) | GPR35TTRVCAM1ABCC3ABCC4 |
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 |