Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 4/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | TDO2 | P48775 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | TACR1 | P25103 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6480579 | 0.88 | SMN1; SMN2 (0.45) | IDO1TDO2SMN1; SMN2L3MBTL1CNR2 | |
| SCHEMBL17295544 | 0.81 | BRD4 (0.48) | BRD4IDO1TDO2CYP17A1 | |
| SCHEMBL17295642 | 0.81 | TSHR (0.41) | BRD4CREBBPIDO1TDO2 | |
| SCHEMBL3929235 | 0.79 | CNR2 (0.50) | BRD4CREBBPIDO1TDO2SMN1; SMN2 | |
| SCHEMBL8271150 | 0.79 | IDO1 (0.43) | IDO1TDO2SMN1; SMN2L3MBTL1CNR2 | |
| SCHEMBL4678 | 0.78 | IDO1 (0.52) | IDO1TDO2SMN1; SMN2L3MBTL1 | |
| SCHEMBL9778009 | 0.76 | SMN1; SMN2 (0.54) | SMN1; SMN2L3MBTL1CNR2CA12CA1 | |
| SCHEMBL477707 | 0.75 | ADRB1 (0.52) | BRD4CREBBPSMN1; SMN2CA12CA1 | |
| SCHEMBL30655591 | 0.75 | BRD4 (0.51) | BRD4CREBBPIDO1TDO2L3MBTL1 | |
| SCHEMBL8592782 | 0.75 | ALDH1A1 (0.43) | IDO1TDO2SMN1; SMN2L3MBTL1CNR2 |
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-2015184405-A1 | AROMATIC COMPOUNDS, COMPOSITIONS AND USES THEREOF | MEDIVATION TECHNOLOGIES, INC. (US) | 2015-12-03 | — | — | WO | disclosed |