Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.76 |
| ▸ | GAA | P10253 | 2/20 | 0.59 |
| ▸ | REV1 | Q9UBZ9 | 1/20 | 0.52 |
| ▸ | KCNK3 | O14649 | 6/20 | 0.51 |
| ▸ | KCNK9 | Q9NPC2 | 6/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SLC27A1 | Q6PCB7 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MGLL | Q99685 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30557943 | 0.96 | CYP3A4 (0.81) | CYP3A4GAAREV1KCNK3KCNK9 | |
| SCHEMBL30557946 | 0.91 | CYP3A4 (0.76) | CYP3A4GAAREV1KCNK3KCNK9 | |
| SCHEMBL30557923 | 0.88 | CYP3A4 (0.71) | CYP3A4GAAKCNK3KCNK9 | |
| SCHEMBL30557935 | 0.87 | CYP3A4 (0.67) | CYP3A4GAAKCNK3KCNK9HTT | |
| SCHEMBL30557939 | 0.87 | CYP3A4 (0.67) | CYP3A4GAAKCNK3KCNK9HTT | |
| SCHEMBL30557932 | 0.85 | CYP3A4 (0.65) | CYP3A4GAAKCNK3KCNK9HTT | |
| SCHEMBL30557924 | 0.84 | CYP3A4 (0.66) | CYP3A4GAAKCNK3KCNK9 | |
| SCHEMBL30557930 | 0.81 | CYP3A4 (0.60) | CYP3A4GAAKCNK3KCNK9HTT | |
| SCHEMBL30557947 | 0.81 | ALDH1A1 (0.54) | CYP3A4KCNK3KCNK9TSHRMAPT | |
| SCHEMBL18952440 | 0.79 | GAA (0.67) | GAAKCNK3KCNK9HTTLMNA |
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 |