Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SELL | P14151 | 1/20 | 0.33 |
| ▸ | SELP | P16109 | 1/20 | 0.33 |
| ▸ | SELE | P16581 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | HPGD | P15428 | 4/20 | 0.32 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | STAT3 | P40763 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2536467 | 0.83 | ACHE (0.46) | ACHECYP3A4HTTSELLSELP | |
| SCHEMBL2570639 | 0.81 | ACHE (0.43) | ACHECYP3A4HTTSELLSELP | |
| SCHEMBL127356 | 0.78 | KDM4E (0.37) | ACHECYP3A4HTTKDM4EHPGD | |
| SCHEMBL4867080 | 0.78 | KDM4E (0.37) | ACHECYP3A4HTTKDM4EHPGD | |
| SCHEMBL29378184 | 0.78 | KDM4E (0.37) | ACHECYP3A4HTTKDM4EHPGD | |
| SCHEMBL2568645 | 0.77 | ACHE (0.40) | ACHECYP3A4HTTGAAALDH1A1 | |
| SCHEMBL26287618 | 0.77 | ACHE (0.40) | ACHECYP3A4HTTKDM4EGAA | |
| Bromide SCHEMBL7236796 | 0.76 | KDM4E (0.36) | ACHEHTTKDM4EGAAALDH1A1 | |
| SCHEMBL5215727 | 0.74 | SMN1; SMN2 (0.34) | ACHECYP3A4HPGDGAAALDH1A1 | |
| SCHEMBL19047158 | 0.74 | ALDH1A1 (0.39) | ACHECYP3A4HTTKDM4EGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-4672125-A | Chlorination of β-methylpyridine compounds | THE DOW CHEMICAL COMPANY (US) | 1987-06-09 | — | — | US | disclosed |