Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.68 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.65 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.65 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.50 |
| ▸ | APP | P05067 | 1/20 | 0.50 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.50 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL4965828 | 1.00 | AKR1C1 (0.68) | AKR1C1CYP11B2CYP19A1CYP1A1CYP1A2 | |
| SCHEMBL9835080 | 1.00 | AKR1C1 (0.68) | AKR1C1CYP11B2CYP19A1CYP1A1CYP1A2 | |
| SCHEMBL8646379 | 0.90 | AKR1C1 (0.68) | AKR1C1CYP11B2CYP19A1CYP1A1CYP1A2 | |
| SCHEMBL8646375 | 0.90 | AKR1C1 (0.68) | AKR1C1CYP11B2CYP19A1CYP1A1CYP1A2 | |
| SCHEMBL5420129 | 0.88 | MAPT (0.58) | AKR1C1CYP11B2CYP19A1CYP1A1CYP1A2 | |
| SCHEMBL5420133 | 0.88 | MAPT (0.58) | AKR1C1CYP11B2CYP19A1CYP1A1CYP1A2 | |
| SCHEMBL19031899 | 0.87 | CYP11B2 (0.53) | AKR1C1CYP11B2CYP19A1CYP1A1CYP1A2 | |
| SCHEMBL19031900 | 0.87 | CYP11B2 (0.53) | AKR1C1CYP11B2CYP19A1CYP1A1CYP1A2 | |
| SCHEMBL16180696 | 0.87 | CYP11B2 (0.61) | AKR1C1CYP11B2CYP19A1CYP1A1CYP1A2 | |
| SCHEMBL24055175 | 0.84 | CYP1A1 (0.62) | AKR1C1CYP1A1CYP1A2CYP1B1CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008113835-A1 | PROCESS FOR PREPARING (R OR S)-5-{1-AZIDO-3-[6-METHOXY-5-(3-METHOXY-PROPOXY)-PYRIDIN-3-YLMETHYL]-4-METHYL-PENTYL}-3-ALKYL-DIHYDRO-FURAN-2-ONE | NOVARTIS AG (CH) | 2008-09-25 | — | — | WO | disclosed |
| EP-0210782-B1 | PYRIDINE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | Dainippon Pharmaceutical Co., Ltd. (JP) | 1991-04-17 | — | — | EP | disclosed |
| US-4778796-A | ω-(3-pyridyl)alkenamide derivatives and anti-allergenic pharmaceutical compositions containing same | DAINIPPON PHARMACEUTICAL CO., LTD. (JP) | 1988-10-18 | — | — | US | disclosed |
| EP-0210782-A2 | Pyridine compounds, process for the preparation thereof and pharmaceutical composition containing the same | Dainippon Pharmaceutical Co., Ltd. (JP) | 1987-02-04 | — | — | EP | disclosed |