Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 7/20 | 0.51 |
| ▸ | HTR6 | P50406 | 6/20 | 0.51 |
| ▸ | HTR1A | P08908 | 5/20 | 0.45 |
| ▸ | HTR2A | P28223 | 3/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | METAP1 | P53582 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29078392 | 1.00 | HTR7 (0.51) | HTR7HTR6HTR1AHTR2AADRA2A | |
| SCHEMBL30585249 | 0.89 | CHKA (0.47) | HTR7HTR6LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL29078367 | 0.89 | CHKA (0.47) | HTR7HTR6LMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL30585265 | 0.85 | ALDH1A1 (0.45) | LMNASMN1; SMN2MAPTALDH1A1MAPK1 | |
| SCHEMBL29078366 | 0.85 | ALDH1A1 (0.45) | LMNASMN1; SMN2MAPTALDH1A1MAPK1 | |
| SCHEMBL30585247 | 0.83 | HTR7 (0.46) | HTR7HTR6HTR1AHTR2AADRA2A | |
| SCHEMBL29078377 | 0.83 | HTR7 (0.46) | HTR7HTR6HTR1AHTR2AADRA2A | |
| SCHEMBL29078415 | 0.78 | FAAH (0.50) | HTR7HTR6HTR1AHTR2AADRA2A | |
| SCHEMBL30585243 | 0.78 | FAAH (0.50) | HTR7HTR6HTR1AHTR2AADRA2A | |
| SCHEMBL29078373 | 0.75 | HTR1A (0.48) | HTR7HTR1AHTR2ADRD3POLB |
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-116803981-A | Piperazine-containing amide or sulfonamide anti-inflammatory compound and preparation method and application thereof | 温州医科大学 | 2023-09-26 | — | — | CN | claimed |
| CN-116803981-A | Piperazine-containing amide or sulfonamide anti-inflammatory compound and preparation method and application thereof | 温州医科大学 | 2023-09-26 | — | — | CN | disclosed |