Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 2/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.32 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.32 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30615095 | 1.00 | ERN1 (0.42) | ERN1APPCXCL12KMT2AMEN1 | |
| SCHEMBL29091598 | 0.81 | CYP3A4 (0.42) | ERN1APPKMT2AMEN1GAA | |
| SCHEMBL30615102 | 0.81 | CYP3A4 (0.42) | ERN1APPKMT2AMEN1GAA | |
| SCHEMBL30615098 | 0.80 | ADORA2A (0.35) | CYP1A2CYP3A4CYP2D6CYP2C19ADORA2A | |
| SCHEMBL22715357 | 0.80 | NQO2 (0.44) | ERN1APPKMT2AMEN1GAA | |
| SCHEMBL29091670 | 0.80 | ADORA2A (0.35) | CYP1A2CYP3A4CYP2D6CYP2C19ADORA2A | |
| SCHEMBL11213463 | 0.78 | PDE5A (0.49) | KDM4EGAACYP3A4POLB | |
| SCHEMBL30615221 | 0.73 | PDE2A (0.34) | KMT2AMEN1KDM4EGAACYP1A2 | |
| SCHEMBL29091634 | 0.73 | PDE2A (0.34) | KMT2AMEN1KDM4EGAACYP1A2 | |
| SCHEMBL29091587 | 0.73 | CYP19A1 (0.39) | KMT2AMEN1KDM4ECYP1A2CYP3A4 |
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 |