Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.61 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.37 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.37 |
| ▸ | HTR2C | P28335 | 5/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 3/20 | 0.35 |
| ▸ | HTR1D | P28221 | 3/20 | 0.35 |
| ▸ | HTR7 | P34969 | 3/20 | 0.35 |
| ▸ | HTR5A | P47898 | 3/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | PNMT | P11086 | 3/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 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 | |
|---|---|---|---|---|
| SCHEMBL18549581 | 0.78 | HTR2A (0.39) | NOTUMADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL31504075 | 0.76 | NOTUM (1.00) | NOTUMADRA2AADRA2BADRA2CHTR2C | |
| SCHEMBL31504074 | 0.76 | NOTUM (1.00) | NOTUMADRA2AADRA2BADRA2CHTR2C | |
| SCHEMBL8526899 | 0.76 | NOTUM (1.00) | NOTUMADRA2AADRA2BADRA2CHTR2C | |
| SCHEMBL31170822 | 0.72 | NOTUM (0.78) | NOTUMADRA2AADRA2BADRA2CHTR2C | |
| SCHEMBL10854921 | 0.72 | NOTUM (0.78) | NOTUMADRA2AADRA2BADRA2CHTR2C | |
| SCHEMBL8529317 | 0.71 | NOTUM (0.53) | NOTUMADRA2AADRA2BADRA2CHTR2C | |
| SCHEMBL31169794 | 0.71 | NOTUM (0.75) | NOTUMADRA2AADRA2BADRA2CHTR2C | |
| SCHEMBL31170811 | 0.68 | NOTUM (0.50) | NOTUMADRA2AADRA2BADRA2CHTR2C | |
| SCHEMBL3717293 | 0.68 | PNMT (0.53) | NOTUMADRA2AADRA2BADRA2CHTR2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112266364-B | Preparation method of tetrahydroquinoxaline compound | 云南民族大学 | 2023-11-17 | — | — | CN | disclosed |
| CN-112266364-A | Preparation method of tetrahydroquinoxaline compound | 云南民族大学 | 2021-01-26 | — | — | CN | disclosed |