Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28290905 | 0.84 | ALOX5 (0.59) | ALOX5HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL27321144 | 0.75 | HTR1A (0.59) | NCF1HTR1ASLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL27452391 | 0.74 | HTR1A (0.58) | NCF1HTR1ASLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL27857393 | 0.74 | HTR1A (0.58) | NCF1HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28030551 | 0.73 | MEN1 (0.41) | ALOX5HTR1ASLC6A2SLC6A4ADRB1 | |
| SCHEMBL28030529 | 0.73 | ADRB1 (0.56) | ALOX5HTR1AADRB1MAPTLMNA | |
| SCHEMBL28290840 | 0.73 | HTR6 (0.39) | NCF1ALOX5HTR1ASLC6A2SLC6A4 | |
| SCHEMBL10873929 | 0.73 | MGLL (0.37) | NCF1ALOX5HTR1AADRB1DRD2 | |
| SCHEMBL28030092 | 0.73 | ADRB1 (0.58) | ALOX5HTR1ASLC6A2SLC6A4ADRB1 | |
| SCHEMBL28145837 | 0.72 | NCF1 (0.50) | NCF1HTR1ASLC6A2SLC6A4SLC6A3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106061950-B | The manufacturing method of pyrazole compound | 住友化学株式会社 | 2019-05-03 | — | — | CN | disclosed |
| CN-104892615-B | Tetrahydro-pyrazole ketone triazin compound and preparation method and application | 河南农业大学 | 2017-04-05 | — | — | CN | disclosed |
| CN-104892615-A | Tetralin pyrazolone triazine compound as well as preparation method and application thereof | UNIV HENAN AGRICULTURAL | 2015-09-09 | — | — | CN | disclosed |