Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 5/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.54 |
| ▸ | DYRK2 | Q92630 | 3/20 | 0.53 |
| ▸ | IGF1R | P08069 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 2/20 | 0.52 |
| ▸ | MAOB | P27338 | 2/20 | 0.52 |
| ▸ | NAT1 | P18440 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.43 |
| ▸ | RAF1 | P04049 | 1/20 | 0.41 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.41 |
| ▸ | AKT1 | P31749 | 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 | |
|---|---|---|---|---|
| SCHEMBL23095004 | 1.00 | IKBKB (0.56) | IKBKBMEN1KMT2AFGFR1DYRK2 | |
| SCHEMBL17693765 | 0.86 | USP18 (0.53) | IKBKBMEN1KMT2AFGFR1DYRK2 | |
| SCHEMBL17899520 | 0.82 | CYP1A2 (0.65) | MEN1KMT2AMAOAMAOBALDH1A1 | |
| SCHEMBL11504353 | 0.81 | IGF1R (0.51) | IKBKBKMT2AIGF1RMAOAMAOB | |
| SCHEMBL11504354 | 0.81 | IGF1R (0.51) | IKBKBKMT2AIGF1RMAOAMAOB | |
| SCHEMBL17899551 | 0.81 | ALDH1A1 (0.52) | IKBKBMEN1KMT2AIGF1RMAOA | |
| SCHEMBL17451483 | 0.81 | IGF1R (0.51) | IKBKBKMT2AIGF1RMAOAMAOB | |
| SCHEMBL13719950 | 0.79 | IKBKB (0.67) | IKBKBMEN1KMT2AFGFR1DYRK2 | |
| SCHEMBL13719949 | 0.79 | IKBKB (0.67) | IKBKBMEN1KMT2AFGFR1DYRK2 | |
| SCHEMBL13719528 | 0.79 | CYP1A2 (0.70) | IKBKBMEN1KMT2AFGFR1DYRK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115232068-B | Compound and preparation method and application thereof | 北京中医药大学 | 2023-09-08 | — | — | CN | disclosed |
| CN-115232068-A | Compound and preparation method and application thereof | 北京中医药大学 | 2022-10-25 | — | — | CN | disclosed |