Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | USP7 | Q93009 | 1/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | LCAT | P04180 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | PLAT | P00750 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17115054 | 0.98 | POLB (0.41) | HRH4HRH3PDE10APOLBCASP3 | |
| SCHEMBL17115090 | 0.93 | PDE10A (0.44) | HRH4HRH3PDE10AUSP7GPR119 | |
| SCHEMBL12506093 | 0.82 | GPR119 (0.56) | POLBCASP3SENP7SENP6GPR119 | |
| SCHEMBL12506078 | 0.81 | GPR119 (0.55) | POLBCASP3SENP7SENP6GPR119 | |
| SCHEMBL19399166 | 0.80 | CHRM3 (0.47) | PDE10APOLBCASP3SENP7SENP6 | |
| SCHEMBL15312852 | 0.79 | GPR119 (0.56) | POLBCASP3SENP7SENP6USP7 | |
| SCHEMBL3694402 | 0.75 | GPR119 (0.59) | USP7GPR119LCATALOX5AP | |
| SCHEMBL17115089 | 0.74 | HRH4 (0.39) | HRH4PDE10AGPR119ALOX5AP | |
| SCHEMBL19454413 | 0.73 | GPR119 (0.46) | POLBUSP7GPR119LCATSMN1; SMN2 | |
| SCHEMBL1103825 | 0.73 | CHRM3 (0.44) | PDE10AUSP7GPR119LCATALOX5AP |
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-105646492-A | Five-membered-aromatic-heterocycte-containing substituted xanthine compound and preparation method and use thereof | 中国医学科学院药物研究所 | 2016-06-08 | — | — | CN | disclosed |