Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGDS | O60760 | 2/20 | 0.45 |
| ▸ | LDHA | P00338 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29242850 | 1.00 | HPGDS (0.45) | HPGDSLDHACYP11B1CYP11B2MAOA | |
| SCHEMBL12345155 | 0.91 | HPGDS (0.51) | HPGDSLDHACYP11B1CYP11B2CHRNB2 | |
| SCHEMBL29655386 | 0.91 | HPGDS (0.51) | HPGDSLDHACYP11B1CYP11B2CHRNB2 | |
| SCHEMBL12435755 | 0.89 | HPGDS (0.50) | HPGDSLDHACYP11B1CYP11B2CHRNB2 | |
| SCHEMBL29134690 | 0.88 | CYP1A2 (0.45) | HPGDSLDHACYP11B1CYP11B2MAOB | |
| SCHEMBL30775115 | 0.88 | CYP1A2 (0.45) | HPGDSLDHACYP11B1CYP11B2MAOB | |
| SCHEMBL12435999 | 0.87 | HPGDS (0.49) | HPGDSLDHACYP11B1CYP11B2CHRNB2 | |
| SCHEMBL12345194 | 0.85 | HPGDS (0.50) | HPGDSLDHACYP11B1CYP11B2CHRNB2 | |
| SCHEMBL28548915 | 0.83 | HPGDS (0.45) | HPGDSLDHACYP11B1CYP11B2CHRNB2 | |
| SCHEMBL29959399 | 0.83 | HPGDS (0.45) | HPGDSLDHACYP11B1CYP11B2CHRNB2 |
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-117999268-A | Organic compound and organic electroluminescent element using same | 索路思高新材料有限公司 | 2024-05-07 | — | — | CN | disclosed |