Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 13/20 | 0.56 |
| ▸ | NPC1 | O15118 | 12/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.50 |
| ▸ | SUV39H2 | Q9H5I1 | 2/20 | 0.50 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL28889668 | 0.83 | RAB9A (0.44) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL28402025 | 0.82 | TLR9 (0.53) | RAB9ANPC1KDM4EMAPTPKM | |
| SCHEMBL1691344 | 0.81 | RAB9A (0.72) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL28403732 | 0.81 | RAB9A (0.61) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL28406931 | 0.81 | RAB9A (0.38) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL28407314 | 0.81 | NPC1 (0.58) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL28398018 | 0.80 | RAB9A (0.52) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL6393875 | 0.77 | SMN1; SMN2 (0.79) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL17492326 | 0.75 | RAB9A (0.60) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL16867102 | 0.75 | RAB9A (0.53) | RAB9ANPC1KDM4EMAPTSMN1; SMN2 |
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-109776574-B | Bis (2- (imidazo [1,2-a ] pyridine-2-yl) phenyl) thioether compound and synthetic method thereof | 郑州大学 | 2020-04-28 | — | — | CN | disclosed |