Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL27990728 | 0.84 | MAP3K7 (0.40) | DYRK1ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL29122661 | 0.82 | DYRK1A (0.38) | THRBDYRK1ASMN1; SMN2ALDH1A1NPC1 | |
| SCHEMBL1761182 | 0.78 | TSHR (0.39) | THRATHRBDYRK1ASMN1; SMN2ALDH1A1 | |
| SCHEMBL28312799 | 0.78 | DYRK1A (0.35) | DYRK1ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL21143326 | 0.76 | EGFR (0.39) | DYRK1AALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL30509819 | 0.76 | EGFR (0.39) | DYRK1AALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL25816117 | 0.75 | PTGES (0.35) | DYRK1ASMN1; SMN2ALDH1A1HPGDNPC1 | |
| SCHEMBL30897137 | 0.73 | DYRK1A (0.32) | DYRK1A | |
| SCHEMBL30976506 | 0.73 | POLB (0.41) | DYRK1ASMN1; SMN2ALDH1A1KDM4EMAOA | |
| SCHEMBL1423571 | 0.73 | POLB (0.41) | DYRK1ASMN1; SMN2ALDH1A1KDM4EMAOA |
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-110078668-A | A kind of phenylimidazole class XOR inhibitor and preparation and application | 华南理工大学 | 2019-08-02 | — | — | CN | disclosed |