Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PSMB1 | P20618 | 2/20 | 0.38 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.38 |
| ▸ | PSMB2 | P49721 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7110089 | 0.84 | HRH3 (0.55) | HRH3LTA4HSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL1469605 | 0.83 | TSHR (0.48) | HRH3LTA4HSMN1; SMN2MAPK1KDM4E | |
| SCHEMBL10914988 | 0.81 | HRH3 (0.52) | HRH3LTA4HSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL9544504 | 0.81 | HRH3 (0.52) | HRH3LTA4HSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL7887990 | 0.81 | HRH3 (0.60) | HRH3LTA4HSMN1; SMN2CYP1A2MAPK1 | |
| SCHEMBL24059343 | 0.81 | HRH3 (0.60) | HRH3LTA4HSMN1; SMN2CYP1A2MAPK1 | |
| SCHEMBL9542003 | 0.81 | HRH3 (0.52) | HRH3LTA4HSMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL8361918 | 0.81 | HRH3 (0.60) | HRH3LTA4HSMN1; SMN2CYP1A2MAPK1 | |
| SCHEMBL10509584 | 0.81 | HRH3 (0.48) | HRH3SMN1; SMN2CYP1A2MAPK1KDM4E | |
| SCHEMBL17528474 | 0.81 | MEN1 (0.50) | HRH3LTA4HSMN1; SMN2MAPK1KDM4E |
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-20110202328-A1 | System for the determination of selective absorbent molecules through predictive correlations | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2011-08-18 | — | — | US | disclosed |
| US-20110202328-A1 | System for the determination of selective absorbent molecules through predictive correlations | EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) | 2011-08-18 | — | — | US | disclosed |