Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K7 | O43318 | 1/20 | 0.40 |
| ▸ | TAB1 | Q15750 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 3/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SCN4A | P35499 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | SCN1A | P35498 | 2/20 | 0.34 |
| ▸ | HTR2B | P41595 | 2/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 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 | |
|---|---|---|---|---|
| SCHEMBL28312806 | 0.84 | THRA (0.40) | DYRK1ASMN1; SMN2MAPK1MAOAHTR2B | |
| SCHEMBL29122661 | 0.81 | DYRK1A (0.38) | DYRK1ASMN1; SMN2MAPK1LMNACYP1A2 | |
| SCHEMBL17028323 | 0.79 | MAP3K7 (0.39) | MAP3K7TAB1XDHSLC22A12 | |
| SCHEMBL21143326 | 0.79 | EGFR (0.39) | DYRK1AXDHTSHRALDH1A1HPGD | |
| SCHEMBL30509819 | 0.79 | EGFR (0.39) | DYRK1AXDHTSHRALDH1A1HPGD | |
| SCHEMBL28866135 | 0.78 | DYRK1A (0.38) | DYRK1AXDHSMN1; SMN2MAPK1LMNA | |
| SCHEMBL6389985 | 0.78 | SMN1; SMN2 (0.32) | DYRK1ASMN1; SMN2MAPK1KDM4EALDH1A1 | |
| SCHEMBL28312799 | 0.77 | DYRK1A (0.35) | DYRK1AXDHSMN1; SMN2MAPK1CYP1A2 | |
| SCHEMBL25816117 | 0.77 | PTGES (0.35) | DYRK1ASMN1; SMN2MAPK1LMNASCN8A | |
| SCHEMBL1761182 | 0.77 | TSHR (0.39) | DYRK1ASMN1; SMN2CYP1A2CYP2C9TSHR |
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 3 patents. 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 |
| CN-103068807-B | By using the preparation method of phenyl substituted heterocycle derivative of coupling process of palladium compound | TEIJIN PHARMA LTD. (JP) | 2016-05-25 | — | — | CN | disclosed |
| CN-102333765-B | Process for producing phenyl-substituted heterocyclic derivative through coupling using transition metal catalyst | TEIJIN PHARMA LTD | 2015-01-14 | — | — | CN | disclosed |