Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25B | P30305 | 2/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 2/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | BCL2 | P10415 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | BAD | Q92934 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3324093 | 0.91 | NR4A1 (0.47) | CDC25BNR4A1NR4A2NR4A3SIGMAR1 | |
| SCHEMBL7188416 | 0.69 | NR4A1 (0.56) | CDC25BNR4A1NR4A2NR4A3SIGMAR1 | |
| SCHEMBL3426760 | 0.69 | AKR1C3 (0.59) | CDC25BAKR1C3NR4A1ATMMYC | |
| SCHEMBL7538800 | 0.68 | NR4A1 (0.63) | CDC25BNR4A1NR4A2NR4A3POLB | |
| SCHEMBL547632 | 0.68 | CDC25B (0.69) | CDC25BAKR1C3NR4A1NR4A2NR4A3 | |
| SCHEMBL29522736 | 0.68 | CDC25B (0.69) | CDC25BAKR1C3NR4A1NR4A2NR4A3 | |
| SCHEMBL12402049 | 0.68 | SIGMAR1 (0.44) | NR4A1NR4A2NR4A3SIGMAR1CYP1A2 | |
| SCHEMBL4168193 | 0.67 | ALDH1A1 (0.57) | NR4A1NR4A2NR4A3SIGMAR1KDM4E | |
| Naphthalene SCHEMBL11467392 | 0.66 | CDC25B (0.67) | CDC25BAKR1C3NR4A1NR4A2NR4A3 | |
| SCHEMBL4869612 | 0.66 | SIGMAR1 (0.56) | NR4A1NR4A2NR4A3SIGMAR1PTPN1 |
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-107984936-B | Reusable writing material and preparation method thereof | 吉林大学 | 2022-05-06 | — | — | CN | disclosed |