Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD5 | P21918 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL20157006 | 0.79 | MAPT (0.33) | HRH3CYP2D6CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL611373 | 0.75 | HRH3 (0.60) | HRH3CYP2D6CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL611239 | 0.73 | TSHR (0.49) | HRH3CYP2D6CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL14456485 | 0.71 | HDAC8 (0.45) | HRH3TSHRHTT | |
| SCHEMBL6915875 | 0.71 | LMNA (0.43) | CYP2D6CYP1A2CYP2C9CYP2C19HIF1A | |
| Hydrochloric Acid SCHEMBL6905460 | 0.70 | LMNA (0.42) | CYP2D6CYP1A2CYP2C9CYP2C19HIF1A | |
| SCHEMBL20157103 | 0.69 | HRH3 (0.39) | HRH3BCHEHTR1AHTR2CHTR2B | |
| SCHEMBL20287494 | 0.68 | HRH3 (0.72) | HRH3CYP2D6CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL18973889 | 0.68 | RARB (0.51) | ALDH1A1MAPT | |
| SCHEMBL24645745 | 0.67 | HRH3 (0.45) | HRH3CYP2D6CYP1A2CYP2C9CYP2C19 |
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-2018089433-A1 | PHENYL mTORC INHIBITORS AND USES THEREOF | NAVITOR PHARMACEUTICALS, INC. (US) | 2018-05-17 | — | — | WO | disclosed |