Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20419551 | 1.00 | AURKA (0.36) | AURKARPS6KB1RAB9AGAAMEN1 | |
| SCHEMBL28835471 | 0.84 | MARS1 (0.42) | AURKARPS6KB1GAAKDM4EALDH1A1 | |
| SCHEMBL23115927 | 0.84 | AURKA (0.39) | AURKARPS6KB1RAB9AGAAMEN1 | |
| SCHEMBL29904888 | 0.81 | MEN1 (0.41) | RAB9AMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL20419545 | 0.81 | MEN1 (0.41) | RAB9AMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL20419549 | 0.81 | AURKA (0.40) | AURKARPS6KB1GAAMEN1KMT2A | |
| SCHEMBL20419395 | 0.78 | NQO2 (0.33) | KDM4EALDH1A1POLBLCKMAPK1 | |
| SCHEMBL29904894 | 0.78 | NQO2 (0.33) | KDM4EALDH1A1POLBLCKMAPK1 | |
| SCHEMBL1739608 | 0.77 | AURKA (0.42) | AURKARPS6KB1RAB9AGAAMEN1 | |
| SCHEMBL28259342 | 0.75 | KDM4E (0.41) | AURKARPS6KB1GAAKDM4EALDH1A1 |
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-109071468-B | Heterocyclic compound and preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2022-09-02 | — | — | CN | disclosed |