Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGXT | P21549 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9064186 | 0.79 | CYP1A2 (0.48) | AGXTCYP1A2CYP2A6TDP1KDM4E | |
| SCHEMBL9064070 | 0.78 | LTA4H (0.42) | MAOAMAOBALDH1A1 | |
| SCHEMBL9064069 | 0.78 | LTA4H (0.42) | MAOAMAOBALDH1A1 | |
| Benzene SCHEMBL10362331 | 0.76 | CYP1A2 (0.43) | AGXTCYP1A2CYP2A6TDP1KDM4E | |
| SCHEMBL3306770 | 0.75 | CYP2A6 (0.54) | AGXTCYP1A2CYP2A6TDP1KDM4E | |
| SCHEMBL1225166 | 0.74 | CYP2A6 (0.52) | AGXTCYP1A2CYP2A6TDP1KDM4E | |
| SCHEMBL5621333 | 0.73 | RELA (0.59) | KDM4EMAPTSMN1; SMN2RELAPTGS1 | |
| SCHEMBL5621330 | 0.73 | RELA (0.59) | KDM4EMAPTSMN1; SMN2RELAPTGS1 | |
| SCHEMBL11131812 | 0.71 | CYP1A2 (0.48) | AGXTCYP1A2CYP2A6TDP1KDM4E | |
| SCHEMBL395026 | 0.70 | CYP1A2 (0.64) | AGXTCYP1A2CYP2A6TDP1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0733364-A1 | MEDICINAL COMPOSITION FOR CIRCULATORY ORGAN | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1996-09-25 | — | — | EP | disclosed |