Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.57 |
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | LTA4H | P09960 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
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) | MEN1KMT2AALDH1A1HPGDL3MBTL1 | |
| SCHEMBL28141074 | 0.84 | ALDH1A1 (0.57) | KMT2ATP53ALOX12ALDH1A1HPGD | |
| SCHEMBL28308952 | 0.84 | CYP3A4 (0.59) | MEN1KMT2AALDH1A1HPGDL3MBTL1 | |
| SCHEMBL12354776 | 0.83 | LTA4H (0.60) | ALDH1A1HPGDLMNALTA4H | |
| SCHEMBL28141070 | 0.82 | ALDH1A1 (0.61) | MEN1KMT2AALDH1A1HPGDL3MBTL1 | |
| SCHEMBL17963199 | 0.82 | ALDH1A1 (0.79) | MEN1KMT2ATP53ALOX12ALDH1A1 | |
| SCHEMBL28309747 | 0.81 | MAPT (0.59) | MEN1KMT2AALDH1A1HPGDL3MBTL1 | |
| SCHEMBL853366 | 0.80 | HTT (0.56) | MEN1KMT2AALDH1A1HPGDPOLB | |
| SCHEMBL28309027 | 0.76 | LMNA (0.62) | MEN1KMT2AALDH1A1L3MBTL1POLB | |
| SCHEMBL28141147 | 0.75 | HPGD (0.55) | MEN1KMT2AALDH1A1HPGDL3MBTL1 |
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-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 |