Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL7598160 | 1.00 | KDM4E (0.69) | KDM4ESMN1; SMN2ALDH1A1ALOX15GAA | |
| SCHEMBL2301745 | 0.93 | KDM4E (0.77) | KDM4ESMN1; SMN2ALDH1A1ALOX15GAA | |
| SCHEMBL9315414 | 0.88 | SMN1; SMN2 (0.56) | KDM4ESMN1; SMN2ALDH1A1ALOX15GAA | |
| SCHEMBL4876987 | 0.87 | KDM4E (0.57) | KDM4ESMN1; SMN2ALDH1A1ALOX15GAA | |
| SCHEMBL11470029 | 0.86 | KDM4E (0.69) | KDM4ESMN1; SMN2ALDH1A1ALOX15GAA | |
| SCHEMBL9315418 | 0.85 | SMN1; SMN2 (0.53) | KDM4ESMN1; SMN2ALDH1A1ALOX15GAA | |
| SCHEMBL14459600 | 0.84 | KDM4E (0.71) | KDM4EALDH1A1ALOX15GAAPOLB | |
| SCHEMBL1640378 | 0.82 | SMN1; SMN2 (1.00) | KDM4ESMN1; SMN2ALDH1A1GAAPOLB | |
| SCHEMBL16387742 | 0.82 | KDM4E (0.64) | KDM4EALDH1A1ALOX15GAAPOLB | |
| SCHEMBL30531213 | 0.81 | SMN1; SMN2 (0.73) | KDM4ESMN1; SMN2ALDH1A1ALOX15GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-113173884-B | Method for synthesizing pyridine and derivative thereof by catalyzing hans ester 1, 4-dihydropyridine compound with titanocene dichloride | 陕西师范大学 | 2023-08-15 | — | — | CN | disclosed |