Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | LTA4H | P09960 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28141066 | 0.86 | ALDH1A1 (0.59) | ALDH1A1HPGDLTA4HLMNAGAA | |
| SCHEMBL28309753 | 0.84 | MEN1 (0.59) | ALDH1A1HPGDLTA4HLMNATP53 | |
| SCHEMBL28309747 | 0.84 | MAPT (0.59) | ALDH1A1HPGDLMNAKMT2A | |
| SCHEMBL12354776 | 0.83 | LTA4H (0.60) | ALDH1A1HPGDLTA4HLMNA | |
| SCHEMBL28141070 | 0.82 | ALDH1A1 (0.61) | ALDH1A1HPGDLTA4HLMNASMN1; SMN2 | |
| SCHEMBL853366 | 0.80 | HTT (0.56) | ALDH1A1HPGDLMNAGAASMN1; SMN2 | |
| SCHEMBL28308952 | 0.78 | CYP3A4 (0.59) | ALDH1A1HPGDLMNAGAAKMT2A | |
| SCHEMBL28141147 | 0.75 | HPGD (0.55) | ALDH1A1HPGDSMN1; SMN2KMT2A | |
| SCHEMBL28141071 | 0.75 | LMNA (0.52) | ALDH1A1HPGDLMNASMN1; SMN2 | |
| SCHEMBL14816847 | 0.74 | HDAC3 (0.64) | ALDH1A1LMNAGAATP53SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106632092-B | A kind of 1,3- dimethyl -7- substituted quinazoline -2,4- cyclohexadione compounds and its synthetic method and application | 重庆智合生物医药有限公司 | 2019-07-16 | — | — | CN | disclosed |
| CN-106632092-A | 1,3-dimethyl-7-substituted-quinazolinyl-2,4-diones, and synthesis method and application thereof | 重庆智合生物医药有限公司 | 2017-05-10 | — | — | CN | disclosed |