Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | KCNK3 | O14649 | 9/20 | 0.53 |
| ▸ | KCNK9 | Q9NPC2 | 9/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.45 |
| ▸ | MMP9 | P14780 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALPL | P05186 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30557925 | 0.92 | CYP3A4 (0.60) | CYP3A4GAAKCNK3KCNK9HDAC1 | |
| SCHEMBL30557938 | 0.92 | CYP3A4 (0.58) | CYP3A4GAAKCNK3KCNK9HDAC1 | |
| SCHEMBL30557931 | 0.92 | CYP3A4 (0.62) | CYP3A4GAAKCNK3KCNK9HDAC1 | |
| SCHEMBL30557941 | 0.92 | CYP3A4 (0.56) | CYP3A4GAAKCNK3KCNK9HDAC1 | |
| SCHEMBL30557934 | 0.89 | CYP3A4 (0.55) | CYP3A4GAAKCNK3KCNK9HDAC1 | |
| SCHEMBL30557928 | 0.86 | CYP3A4 (0.56) | CYP3A4GAAKCNK3KCNK9HDAC1 | |
| SCHEMBL30557935 | 0.84 | CYP3A4 (0.67) | CYP3A4GAAKCNK3KCNK9MAPT | |
| SCHEMBL30557943 | 0.83 | CYP3A4 (0.81) | CYP3A4GAAKCNK3KCNK9MAPT | |
| SCHEMBL30557940 | 0.81 | CYP3A4 (0.76) | CYP3A4GAAKCNK3KCNK9MAPT | |
| SCHEMBL30557939 | 0.80 | CYP3A4 (0.67) | CYP3A4GAAKCNK3KCNK9MAPT |
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-115160313-B | 2-phenylimidazole [1,2-a ] pyridine compound, composition containing same and application of 2-phenylimidazole [1,2-a ] pyridine compound and composition | 中国药科大学 | 2023-09-05 | — | — | CN | disclosed |