Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | TDP2 | O95551 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | ALKBH3 | Q96Q83 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.38 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9224688 | 0.96 | APP (0.49) | APPCYP2C19TDP2CYP11B1CYP11B2 | |
| SCHEMBL9221523 | 0.87 | CYP2C19 (0.51) | APPCYP2C19CYP11B1CYP11B2AKR1C3 | |
| SCHEMBL9227566 | 0.87 | CYP2C19 (0.51) | APPCYP2C19CYP11B1CYP11B2AKR1C3 | |
| SCHEMBL9276401 | 0.86 | FEN1 (0.37) | APPCYP2C19TDP2AKR1C3AKR1C2 | |
| SCHEMBL9225243 | 0.85 | GRM2 (0.38) | TDP2AKR1C3AKR1C2ALKBH3CYP17A1 | |
| SCHEMBL9228824 | 0.85 | FFAR1 (0.42) | CYP11B1CYP11B2PTGS2ALDH1A1ALOX5AP | |
| SCHEMBL9226641 | 0.83 | RARA (0.41) | ALDH1A1ALOX5APFEN1ERN1FFAR1 | |
| SCHEMBL9228557 | 0.83 | RARB (0.46) | CYP2C19PPARD | |
| SCHEMBL9220392 | 0.82 | CYP2C19 (0.56) | APPCYP2C19AKR1C3AKR1C2ABCB1 | |
| SCHEMBL9224111 | 0.82 | CYP17A1 (0.41) | TDP2CYP17A1ALDH1A1ALOX5APFEN1 |
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 3 patents. 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 |
| EP-0413785-A1 | LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS. | MERCK PATENT GMBH (DE) | 1991-02-27 | — | — | EP | disclosed |
| WO-1990009420-A1 | LIQUID CRYSTALLINE MEDIA CONTAINING FLUORINATED OLIGOPHENYLS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-08-23 | — | — | WO | disclosed |