Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28312799 | 0.84 | DYRK1A (0.35) | MCHR1SMN1; SMN2MAPK1XDHNPC1 | |
| SCHEMBL4433039 | 0.83 | DHODH (0.35) | MCHR1 | |
| SCHEMBL28311175 | 0.76 | MAPK1 (0.43) | MCHR1SMN1; SMN2MAPK1XDHPOLB | |
| SCHEMBL8970180 | 0.75 | MCHR1 (0.45) | MCHR1 | |
| SCHEMBL2043468 | 0.75 | MCHR1 (0.45) | MCHR1TDP1L3MBTL1 | |
| SCHEMBL2410915 | 0.73 | MCHR1 (0.48) | MCHR1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28986732 | 0.73 | XDH (0.46) | XDHS1PR1MAOAS1PR3S1PR5 | |
| SCHEMBL2410917 | 0.73 | MCHR1 (0.48) | MCHR1ALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9001613 | 0.73 | SMN1; SMN2 (0.40) | SMN1; SMN2MAPK1XDHPOLBGAA | |
| SCHEMBL31490284 | 0.72 | MCHR1 (0.51) | MCHR1ADRA2AADRA2BALDH1A1 |
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-109705848-B | One-dimensional organic semiconductor nanocoil and preparation method and application thereof | 中国科学院化学研究所 | 2021-02-26 | — | — | CN | disclosed |