Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 11/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | CTSG | P08311 | 1/20 | 0.41 |
| ▸ | CMA1 | P23946 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28796619 | 0.89 | GRM2 (0.51) | GRM2NPC1RAB9ASIGMAR1DRD4 | |
| SCHEMBL8104890 | 0.84 | GRM2 (0.75) | GRM2 | |
| SCHEMBL7611507 | 0.73 | ALDH1A1 (0.61) | SIGMAR1 | |
| SCHEMBL6641309 | 0.73 | ALDH1A1 (0.61) | SIGMAR1 | |
| SCHEMBL9737497 | 0.73 | ALDH1A1 (0.61) | SIGMAR1 | |
| SCHEMBL517975 | 0.73 | ALDH1A1 (0.61) | SIGMAR1 | |
| SCHEMBL8105930 | 0.73 | GRM2 (0.71) | GRM2 | |
| SCHEMBL8118884 | 0.73 | GRM2 (0.58) | GRM2NPC1RAB9A | |
| SCHEMBL8113587 | 0.72 | GRM2 (0.53) | GRM2 | |
| SCHEMBL11739927 | 0.70 | MAPT (0.57) | NPC1SIGMAR1 |
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-102526022-A | Application of epigallocatechin-3-gallate in preparation of antitumor drug | UNIV FUDAN | 2012-07-04 | — | — | CN | disclosed |