Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15688169 | 0.83 | KCNJ1 (0.48) | NR1H2KCNJ1ALDH1A1LMNAMAPK1 | |
| SCHEMBL29958940 | 0.80 | ALDH1A1 (0.42) | NR1H2KCNJ1ALDH1A1LMNAMAPK1 | |
| SCHEMBL27088090 | 0.79 | NR1H2 (0.43) | NR1H2CFTRKCNJ1ALDH1A1LMNA | |
| SCHEMBL588829 | 0.79 | NR1H2 (0.62) | NR1H2ALDH1A1LMNASMN1; SMN2CTSB | |
| SCHEMBL1420633 | 0.79 | NR1H2 (0.49) | NR1H2KCNJ1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL15687898 | 0.79 | SCN9A (0.42) | NR1H2KCNJ1ALDH1A1LMNAMAPK1 | |
| SCHEMBL15687902 | 0.78 | MEN1 (0.48) | NR1H2KCNJ1ALDH1A1LMNASMN1; SMN2 | |
| Tert-Butyl Formate SCHEMBL28331623 | 0.78 | DDR1 (0.41) | NR1H2CFTRKCNJ1ALDH1A1LMNA | |
| SCHEMBL15688039 | 0.77 | LMNA (0.50) | NR1H2KCNJ1ALDH1A1LMNAMAPK1 | |
| SCHEMBL31053461 | 0.77 | ACHE (0.53) | NR1H2KCNJ1ALDH1A1LMNAMAPK1 |
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-109641893-A | NOVEL IMIDAZOPYRIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING CANCER | 大邱庆北尖端医疗产业振兴财团 | 2019-04-16 | — | — | CN | disclosed |