Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.48 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.48 |
| ▸ | CCR5 | P51681 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 3/20 | 0.47 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 2/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1401365 | 0.85 | DRD2 (0.56) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL4589565 | 0.84 | DRD2 (0.55) | CYP1A2CYP3A4CYP2D6TSHRCYP2C19 | |
| SCHEMBL1401478 | 0.81 | DRD2 (0.56) | SIGMAR1CYP1A2CYP3A4CYP2D6TSHR | |
| SCHEMBL4589615 | 0.79 | DRD4 (0.49) | HRH3DRD2SLC6A4DRD4ROCK2 | |
| SCHEMBL9374358 | 0.76 | SIGMAR1 (0.81) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL10466061 | 0.74 | SIGMAR1 (0.53) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL9312515 | 0.72 | SIGMAR1 (0.66) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL9422688 | 0.72 | DRD2 (0.63) | SIGMAR1HRH3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL12523836 | 0.72 | HRH3 (0.49) | SIGMAR1HRH3MEN1TP53CYP1A2 | |
| SCHEMBL18756979 | 0.72 | HRH3 (0.59) | SIGMAR1HRH3MEN1TP53CYP1A2 |
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-7326720-B2 | Phenyl- and pyridylpiperidines with TNF activity | SANOFI-AVENTIS (FR) | 2008-02-05 | — | — | US | claimed |