Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 9/20 | 0.40 |
| ▸ | HTR2A | P28223 | 5/20 | 0.36 |
| ▸ | HTR2C | P28335 | 5/20 | 0.36 |
| ▸ | HTR2B | P41595 | 4/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.32 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.32 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.31 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.31 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.31 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.31 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8006857 | 0.88 | HTR2A (0.41) | KMOHTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL8007690 | 0.78 | HTR2A (0.40) | KMOHTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL906040 | 0.75 | HTR2A (0.60) | KMOHTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL8007092 | 0.71 | HTR2C (0.48) | KMOHTR2AHTR2CHTR2BHTR1A | |
| Ammonia Solution, Strong SCHEMBL906042 | 0.67 | KMO (0.42) | KMOHTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL7777106 | 0.67 | SLC22A12 (0.37) | HTR2AHTR2C | |
| Fumaric Acid SCHEMBL8009278 | 0.67 | HTR2A (0.58) | KMOHTR2AHTR2CHTR2BHTR1A | |
| Fumaric Acid SCHEMBL8009273 | 0.67 | HTR2A (0.58) | KMOHTR2AHTR2CHTR2BHTR1A | |
| Fumaric Acid SCHEMBL8006854 | 0.67 | HTR2A (0.58) | KMOHTR2AHTR2CHTR2BHTR1A | |
| SCHEMBL906041 | 0.64 | SLC6A4 (0.36) | 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 |