Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | TERT | O14746 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | NOS2 | P35228 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28056958 | 0.81 | MGLL (0.41) | SLC6A2SLC6A4SLC6A3DRD3KCNH2 | |
| SCHEMBL28056956 | 0.81 | MAPT (0.41) | TSHRGAAALDH1A1HPGDL3MBTL1 | |
| SCHEMBL28056871 | 0.81 | EPHX1 (0.35) | SLC6A9TSHRGAAALDH1A1 | |
| SCHEMBL28056873 | 0.80 | MAPT (0.52) | KCNH2TSHRL3MBTL1 | |
| SCHEMBL28056875 | 0.79 | KDM4E (0.43) | TSHRALDH1A1HPGD | |
| SCHEMBL28056869 | 0.78 | FFAR1 (0.33) | — | |
| SCHEMBL28056953 | 0.76 | KDM4E (0.36) | POLBDRD3TERTALDH1A1 | |
| SCHEMBL28056874 | 0.74 | PNMT (0.32) | — | |
| SCHEMBL7165834 | 0.72 | TERT (0.43) | POLBTERTTSHRGAAALDH1A1 | |
| SCHEMBL28826651 | 0.71 | ABAT (0.35) | NOS3NOS1NOS2ALDH1A1 |
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-103992265-B | Two three bromo 1,3-bis-pyridine alkali propane and preparation method thereof, using method, recovery method and application | XI'AN JIAOTONG UNIVERSITY (CN) | 2016-02-24 | — | — | CN | disclosed |