Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | KDM1A | O60341 | 9/20 | 0.36 |
| ▸ | RCOR1 | Q9UKL0 | 3/20 | 0.36 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.34 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 6/20 | 0.33 |
| ▸ | MAOB | P27338 | 6/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL11524465 | 0.79 | HTR2A (0.39) | HTR2ACYSLTR2CYSLTR1ADRA2AADRA2B | |
| SCHEMBL30886993 | 0.79 | HTR2A (0.39) | HTR2ACYSLTR2CYSLTR1ADRA2AADRA2B | |
| SCHEMBL30839578 | 0.79 | HTR2A (0.39) | HTR2ACYSLTR2CYSLTR1ADRA2AADRA2B | |
| SCHEMBL10316488 | 0.75 | HTR2A (0.35) | HTR2AKDM1ARCOR1MAOAMAOB | |
| SCHEMBL3000893 | 0.75 | HTR2A (0.35) | HTR2AKDM1ARCOR1MAOAMAOB | |
| SCHEMBL17216277 | 0.73 | CYP3A4 (0.32) | KDM1AMAOAMAOB | |
| SCHEMBL2988144 | 0.68 | HTR2A (0.31) | HTR2AKDM1ARCOR1 | |
| SCHEMBL2994793 | 0.68 | HTR2A (0.31) | HTR2AKDM1ARCOR1 | |
| SCHEMBL18407437 | 0.68 | HTR5A (0.38) | KDM1ARCOR1MAOAMAOBADRA2A | |
| SCHEMBL9637453 | 0.66 | SLC6A2 (0.38) | HTR2AKDM1ARCOR1ADRA2AADRA2B |
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 |
|---|---|---|---|---|---|---|---|
| US-4620056-A | ALKYLATION OF SUBSTITUTED AROMATIC HYDROCARBON WITH OLEFINS IN THE PRESENCE OF SODIUM AND A POTASSIUM COMPOUND | NIPPON PETROCHEMICALS CO., LTD. (JP) | 1986-10-28 | — | — | US | disclosed |
| EP-0173335-A2 | Method for producing aromatic hydrocarbons | NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) | 1986-03-05 | — | — | EP | disclosed |