Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.54 |
| ▸ | RAB9A | P51151 | 8/20 | 0.54 |
| ▸ | NPC1 | O15118 | 7/20 | 0.54 |
| ▸ | PLAUR | Q03405 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | PYGM | P11217 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KHK | P50053 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL28663931 | 1.00 | KDM4E (0.54) | KDM4ERAB9ANPC1PLAURALDH1A1 | |
| SCHEMBL29073870 | 0.82 | CYP1A2 (0.46) | KDM4ERAB9ANPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL13768217 | 0.79 | KDM4E (0.60) | KDM4ERAB9ANPC1PLAURALDH1A1 | |
| SCHEMBL30868882 | 0.75 | PLAUR (0.51) | KDM4ERAB9ANPC1PLAURALDH1A1 | |
| SCHEMBL1879820 | 0.75 | BCHE (0.59) | KDM4ERAB9ANPC1ALDH1A1HSD17B10 | |
| SCHEMBL30831170 | 0.75 | BCHE (0.59) | KDM4ERAB9ANPC1ALDH1A1HSD17B10 | |
| SCHEMBL1901480 | 0.70 | RAB9A (1.00) | KDM4ERAB9ANPC1PLAURALDH1A1 | |
| SCHEMBL29820118 | 0.70 | RAB9A (1.00) | KDM4ERAB9ANPC1PLAURALDH1A1 | |
| SCHEMBL1589916 | 0.69 | PLAUR (0.61) | KDM4ERAB9ANPC1PLAURALDH1A1 | |
| SCHEMBL16403339 | 0.69 | PLAUR (0.61) | KDM4ERAB9ANPC1PLAURALDH1A1 |
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-113603651-B | Method for preparing 3-sulfur substituted quinoxalinone derivatives by catalysis | 浙江树人学院（浙江树人大学） | 2022-12-13 | — | — | CN | disclosed |
| CN-113603651-B | Method for preparing 3-sulfur substituted quinoxalinone derivatives by catalysis | 浙江树人学院（浙江树人大学） | 2022-12-13 | — | — | CN | disclosed |