Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.61 |
| ▸ | HPGD | P15428 | 7/20 | 0.61 |
| ▸ | GAA | P10253 | 5/20 | 0.61 |
| ▸ | GLA | P06280 | 2/20 | 0.61 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.61 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 8/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 7/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.41 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5574433 | 0.85 | ALDH1A1 (0.48) | KDM4EALDH1A1HPGDGAAGLA | |
| SCHEMBL10462174 | 0.81 | KDM4E (0.40) | KDM4EALDH1A1HPGDGAAGLA | |
| SCHEMBL27397322 | 0.77 | KDM4E (0.50) | KDM4EALDH1A1HPGDGAAGLA | |
| SCHEMBL11833611 | 0.77 | STAT3 (0.51) | KDM4EALDH1A1HPGDGAAGLA | |
| SCHEMBL83810 | 0.75 | KDM4E (0.41) | KDM4EALDH1A1HPGDGAAGLA | |
| SCHEMBL7037632 | 0.74 | EGLN1 (0.51) | ALDH1A1NPC1KMT2ARAB9AMEN1 | |
| SCHEMBL9356553 | 0.73 | ALDH1A1 (0.50) | KDM4EALDH1A1HPGDGAAGLA | |
| SCHEMBL13448507 | 0.73 | GRM2 (0.43) | KDM4EALDH1A1HPGDGAAGLA | |
| SCHEMBL26750149 | 0.73 | GRM2 (0.39) | KDM4EALDH1A1HPGDGAAGLA | |
| SCHEMBL25316781 | 0.72 | NPC1 (0.49) | KDM4EALDH1A1HPGDGAAGLA |
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 |
|---|---|---|---|---|---|---|---|
| US-4645766-A | 1,2-dihydro-2-oxo-3-hydroxymethyl pyridines, compositions and use | THE UPJOHN COMPANY (US) | 1987-02-24 | — | — | US | disclosed |
| US-4108630-A | 1-Alkylpyrid-2-ones | ROHM AND HAAS COMPANY (US) | 1978-08-22 | — | — | US | disclosed |
| US-4038065-A | 1-ALKYLPYRID-2-ONE | ROHM AND HAAS COMPANY (US) | 1977-07-26 | — | — | US | disclosed |