Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.34 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | CTSE | P14091 | 1/20 | 0.32 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.32 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.32 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | STS | P08842 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28413288 | 1.00 | HTR6 (0.35) | HTR6P2RX3BACE1KDM1APDE4A | |
| SCHEMBL17542918 | 0.93 | THRB (0.32) | ALDH1A1L3MBTL1THRBMEN1KMT2A | |
| SCHEMBL17543649 | 0.93 | THRB (0.32) | ALDH1A1L3MBTL1THRBMEN1KMT2A | |
| SCHEMBL28413757 | 0.93 | HTR6 (0.34) | HTR6P2RX3BACE1KDM1APDE4A | |
| SCHEMBL28891831 | 0.93 | HTR6 (0.34) | HTR6P2RX3BACE1KDM1APDE4A | |
| SCHEMBL28413584 | 0.90 | P2RX7 (0.33) | HTR6P2RX3BACE1KDM1APDE4A | |
| SCHEMBL28410288 | 0.89 | KDM1A (0.34) | HTR6P2RX3BACE1KDM1APDE4A | |
| SCHEMBL28410814 | 0.88 | HTR6 (0.37) | HTR6P2RX3BACE1KDM1ACTSD | |
| SCHEMBL28420085 | 0.88 | HTR6 (0.37) | HTR6P2RX3BACE1KDM1ACTSD | |
| SCHEMBL17542909 | 0.86 | THRB (0.32) | ALDH1A1L3MBTL1THRBMAPTTP53 |
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-106795117-B | Heterobicyclic compounds and their use for the treatment of tuberculosis | 大塚制药株式会社 | 2020-06-26 | — | — | CN | disclosed |