Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 6/20 | 0.47 |
| ▸ | HRH1 | P35367 | 3/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | PRKACA | P17612 | 1/20 | 0.33 |
| ▸ | PRKACG | P22612 | 1/20 | 0.33 |
| ▸ | PRKACB | P22694 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL29960643 | 0.84 | HTR2A (0.46) | HTR2AHRH1HTR2CRETCYP2D6 | |
| SCHEMBL8367488 | 0.79 | HTR2A (0.34) | HTR2AHRH1HTR2CCYP2D6SLC6A2 | |
| SCHEMBL7950524 | 0.79 | MTNR1A (0.33) | HTR2AHRH1HTR2CRETHTR6 | |
| SCHEMBL24206347 | 0.76 | HTR2A (0.55) | HTR2AHRH1HTR2CRETCYP2D6 | |
| SCHEMBL29960735 | 0.75 | MEN1 (0.31) | HTR2AHRH1HTR2CRETHTR6 | |
| SCHEMBL19852205 | 0.75 | NOTUM (0.33) | HTR2AHRH1HTR2CRETHTR6 | |
| SCHEMBL17061157 | 0.75 | NOTUM (0.33) | HTR2AHRH1HTR2CRETHTR6 | |
| Hydrochloric Acid SCHEMBL29960736 | 0.73 | HTR2A (0.47) | HTR2AHRH1HTR2CCYP2D6SLC6A2 | |
| SCHEMBL29960678 | 0.73 | PPARD (0.42) | — | |
| SCHEMBL15056539 | 0.73 | PPARD (0.42) | — |
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-2022204150-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CNS DISORDERS | BLUE OAK PHARMACEUTICALS, INC. (US) | 2022-09-29 | — | — | WO | disclosed |