Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | SLC1A2 | P43004 | 6/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | THPO | P40225 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.37 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.37 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16326618 | 1.00 | PKM (0.43) | PKMSLC1A2CYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL31289285 | 1.00 | PKM (0.43) | PKMSLC1A2CYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL1592286 | 1.00 | PKM (0.43) | PKMSLC1A2CYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL27788944 | 1.00 | PKM (0.43) | PKMSLC1A2CYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL1592240 | 1.00 | PKM (0.43) | PKMSLC1A2CYP1A2ALDH1A1CYP2C19 | |
| Hydrochloric Acid SCHEMBL25225659 | 0.98 | PKM (0.42) | PKMSLC1A2CYP1A2ALDH1A1CYP2C19 | |
| Hydrochloric Acid SCHEMBL4300372 | 0.98 | PKM (0.42) | PKMSLC1A2CYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL28732867 | 0.98 | PKM (0.42) | PKMSLC1A2CYP1A2ALDH1A1CYP2C19 | |
| Lithium SCHEMBL29718901 | 0.98 | PKM (0.42) | PKMSLC1A2CYP1A2ALDH1A1CYP2C19 | |
| SCHEMBL30703914 | 0.98 | PKM (0.42) | PKMSLC1A2CYP1A2ALDH1A1CYP2C19 |
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-105441401-A | Monoamine oxidase and application thereof in synthesis of chiral azabicyclic compounds | NANJING ABIOCHEM BIOMEDICAL TECH CO LTD | 2016-03-30 | — | — | CN | disclosed |