Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 6/20 | 0.43 |
| ▸ | HTR2A | P28223 | 5/20 | 0.41 |
| ▸ | HTR2C | P28335 | 5/20 | 0.41 |
| ▸ | HTR2B | P41595 | 4/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.41 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7997838 | 1.00 | KMO (0.43) | KMOHTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL8007796 | 0.84 | CA2 (0.42) | KMOHTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL24782853 | 0.78 | KMO (0.45) | KMOHTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL26989485 | 0.75 | ITGA4 (0.36) | TRPA1MAPTITGA4ITGB7 | |
| SCHEMBL26988130 | 0.75 | ITGA4 (0.36) | TRPA1MAPTITGA4ITGB7 | |
| SCHEMBL26988251 | 0.75 | ITGA4 (0.36) | TRPA1MAPTITGA4ITGB7 | |
| SCHEMBL8007696 | 0.74 | HTR2A (0.54) | KMOHTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL25702553 | 0.74 | GABRG2 (0.46) | KMOGABRG2GABRB3GABRA5GSK3B | |
| SCHEMBL8007544 | 0.72 | HTR2C (0.69) | KMOHTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL8009907 | 0.72 | HTR2C (0.69) | KMOHTR2AHTR2CHTR2BHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000017170-A2 | N1-SUBSTITUTED BENZOPYRAZOLES AS INHIBITORS OF 5-HT2 RECEPTORS | VERNALIS RESEARCH LIMITED (GB) | 2000-03-30 | — | — | WO | disclosed |