Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 2/20 | 0.49 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.49 |
| ▸ | RARB | P10826 | 4/20 | 0.48 |
| ▸ | FAAH | O00519 | 6/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9223360 | 1.00 | PTPN11 (0.49) | PTPN11NR5A1RARBFAAHTP53 | |
| SCHEMBL9219095 | 1.00 | PTPN11 (0.49) | PTPN11NR5A1RARBFAAHTP53 | |
| SCHEMBL9219108 | 1.00 | PTPN11 (0.49) | PTPN11NR5A1RARBFAAHTP53 | |
| SCHEMBL9227095 | 1.00 | PTPN11 (0.49) | PTPN11NR5A1RARBFAAHTP53 | |
| SCHEMBL9224717 | 0.98 | PTPN11 (0.47) | PTPN11NR5A1RARBFAAHTSHR | |
| SCHEMBL9224119 | 0.95 | FAAH (0.48) | RARBFAAHTSHRCYP3A4CYP2D6 | |
| SCHEMBL13648658 | 0.91 | PTPN11 (0.52) | PTPN11NR5A1RARBTSHR | |
| SCHEMBL13648644 | 0.91 | PTPN11 (0.52) | PTPN11NR5A1RARBTSHR | |
| SCHEMBL9247693 | 0.91 | PTPN11 (0.54) | PTPN11NR5A1RARBTP53TSHR | |
| SCHEMBL9244788 | 0.91 | PTPN11 (0.54) | PTPN11NR5A1RARBTP53TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0413785-B1 | LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS | MERCK PATENT GMBH (DE) | 1995-12-20 | — | — | EP | disclosed |