Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 5/20 | 0.67 |
| ▸ | TTR | P02766 | 2/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | ALB | P02768 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11805184 | 0.80 | GSK3B (0.50) | GSK3BTTRTDP1MEN1ALDH1A1 | |
| SCHEMBL6929091 | 0.80 | GSK3B (0.62) | GSK3BTDP1ALDH1A1RECQL | |
| SCHEMBL4458695 | 0.75 | TTR (0.68) | TTRCYP3A4TSHRTDP1ESR1 | |
| SCHEMBL1114408 | 0.73 | TTR (1.00) | TTRCYP3A4TSHRTDP1ESR1 | |
| SCHEMBL28885871 | 0.73 | TTR (0.65) | TTRCYP3A4TSHRTDP1ESR1 | |
| SCHEMBL11800400 | 0.72 | AKR1C4 (0.62) | GSK3BTTRCYP3A4TSHRTDP1 | |
| SCHEMBL11806725 | 0.71 | TTR (0.62) | TTRCYP3A4TSHRTDP1ESR1 | |
| SCHEMBL1191399 | 0.71 | TTR (0.62) | TTRCYP3A4TSHRTDP1ESR1 | |
| SCHEMBL29175300 | 0.71 | TTR (0.62) | TTRCYP3A4TSHRTDP1ESR1 | |
| SCHEMBL4351080 | 0.71 | TTR (0.62) | TTRCYP3A4TSHRTDP1ESR1 |
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 |