Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | TDO2 | P48775 | 2/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | EEF2K | O00418 | 2/20 | 0.33 |
| ▸ | F2 | P00734 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | OPRL1 | P41146 | 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 | |
|---|---|---|---|---|
| SCHEMBL6001389 | 0.75 | HRH1 (0.54) | IDO1TDO2CYP19A1CNR2GAA | |
| SCHEMBL7299070 | 0.74 | CYP19A1 (0.43) | IDO1TDO2CYP19A1CNR2GAA | |
| SCHEMBL14607651 | 0.73 | IDO1 (0.44) | IDO1TDO2CYP19A1CNR2GAA | |
| SCHEMBL8201735 | 0.73 | HRH1 (0.50) | CYP19A1CNR2CNR1CYP3A4OPRM1 | |
| SCHEMBL11994152 | 0.71 | CYP19A1 (0.43) | IDO1TDO2CYP19A1CNR2ALDH1A1 | |
| SCHEMBL11258009 | 0.69 | IDO1 (0.42) | IDO1TDO2CNR2GAACES2 | |
| SCHEMBL31084151 | 0.69 | CNR2 (0.46) | IDO1TDO2CNR2GAACES2 | |
| SCHEMBL5488485 | 0.69 | CYP3A4 (0.41) | IDO1TDO2CNR2CES2CES1 | |
| SCHEMBL21910179 | 0.69 | IDO1 (0.47) | IDO1TDO2CNR2GAACES2 | |
| SCHEMBL8204422 | 0.68 | CYP19A1 (0.45) | CYP19A1CNR2CNR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6022987-A | Aryl substituted alkylsilanes and a preparation method thereof | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2000-02-08 | — | — | US | disclosed |