Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.49 |
| ▸ | BRD4 | O60885 | 6/20 | 0.47 |
| ▸ | BRD2 | P25440 | 3/20 | 0.47 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.47 |
| ▸ | TUBB | P07437 | 1/20 | 0.47 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.47 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.47 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.47 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.47 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.47 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.47 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.47 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.47 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.47 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.47 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.47 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.47 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL26348154 | 0.81 | ALDH1A1 (0.46) | HTTBRD4BRD2TUBB4ATUBB | |
| SCHEMBL30860393 | 0.79 | HTT (0.49) | HTTBRD4BRD2TUBB4ATUBB | |
| SCHEMBL3803421 | 0.79 | HTT (0.49) | HTTBRD4BRD2TUBB4ATUBB | |
| SCHEMBL18660612 | 0.71 | HTT (0.80) | HTTBRD4BRD2MEN1KMT2A | |
| SCHEMBL31518440 | 0.68 | HTT (0.57) | HTTPOLBSMN1; SMN2L3MBTL1GAA | |
| SCHEMBL21606267 | 0.68 | NR1H2 (0.43) | HTTMEN1KMT2AALDH1A1LMNA | |
| SCHEMBL31539452 | 0.68 | MAPK1 (0.49) | HTTBRD4BRD2TUBB4ATUBB | |
| SCHEMBL398818 | 0.67 | TDP2 (0.66) | HTTALDH1A1GAA | |
| SCHEMBL29713338 | 0.67 | TDP2 (0.66) | HTTALDH1A1GAA | |
| SCHEMBL26338105 | 0.67 | AMPD2 (0.40) | HTTBRD4ALDH1A1PARP1 |
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-106146416-B | Nitrogen replaces 3- oxo -6- substituted-tetrahydro quinoxaline structural compounds, preparation method and its medical usage | 河南大学 | 2019-02-19 | — | — | CN | disclosed |
| CN-106146416-A | Nitrogen replaces 3 oxo 6 substituted-tetrahydro quinoxaline structural compounds, its preparation method and medical usage thereof | 河南大学 | 2016-11-23 | — | — | CN | disclosed |