Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 7/20 | 0.34 |
| ▸ | PDE4A | P27815 | 6/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29091587 | 1.00 | CYP19A1 (0.39) | CYP19A1CYP11B1CYP11B2CYP17A1NQO2 | |
| SCHEMBL29091649 | 0.81 | ALDH1A1 (0.49) | NQO2ALDH1A1HIF1AEPAS1TDO2 | |
| SCHEMBL29091666 | 0.80 | NQO2 (0.38) | CYP11B1CYP11B2CYP17A1NQO2ALDH1A1 | |
| SCHEMBL30615194 | 0.80 | NQO2 (0.38) | CYP11B1CYP11B2CYP17A1NQO2ALDH1A1 | |
| SCHEMBL29091600 | 0.77 | KDM4E (0.39) | ALDH1A1KDM4EMAPTLMNAPOLB | |
| SCHEMBL15857826 | 0.76 | KDM4E (0.45) | NQO2ALDH1A1KDM4EMAPTLMNA | |
| SCHEMBL13079806 | 0.75 | CYP19A1 (0.39) | CYP19A1CYP11B1CYP11B2CYP17A1ALDH1A1 | |
| SCHEMBL29091650 | 0.75 | KMT2A (0.50) | NQO2ALDH1A1PDE4DPDE4APDE4B | |
| SCHEMBL27053770 | 0.74 | NQO2 (0.31) | NQO2 | |
| SCHEMBL29091623 | 0.73 | ERN1 (0.42) | NQO2ALDH1A1PDE4DPDE4AKDM4E |
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-116925100-A | Substituted thiophenoquinolinone compound and preparation method and application thereof | 深圳信立泰药业股份有限公司 | 2023-10-24 | — | — | CN | disclosed |