Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.52 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | SSTR5 | P35346 | 7/20 | 0.47 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 1/20 | 0.47 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.43 |
| ▸ | RET | P07949 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | CKS1B | P61024 | 1/20 | 0.43 |
| ▸ | SKP1 | P63208 | 1/20 | 0.43 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL16811790 | 0.94 | SMO (0.54) | SMODRD4SSTR5SSTR1HRH1 | |
| SCHEMBL16811810 | 0.93 | SMO (0.56) | SMODRD4SSTR5SSTR1HRH1 | |
| SCHEMBL18286499 | 0.93 | SMO (0.54) | SMODRD4SSTR5AKT1MAPK8 | |
| SCHEMBL18286473 | 0.91 | SMO (0.52) | SMODRD4SSTR5AKT1MAPK8 | |
| SCHEMBL18286596 | 0.91 | SMO (0.49) | SMODRD4SSTR5UTS2RMCHR1 | |
| SCHEMBL16811797 | 0.90 | SMO (0.67) | SMODRD4SSTR5SSTR1HRH1 | |
| SCHEMBL18286494 | 0.90 | SMO (0.57) | SMODRD4SSTR5SSTR1HRH1 | |
| SCHEMBL16812727 | 0.89 | SMO (0.49) | SMODRD4SSTR5SSTR1HRH1 | |
| SCHEMBL18286471 | 0.89 | SMO (0.60) | SMODRD4SSTR5SSTR1HRH1 | |
| SCHEMBL16811949 | 0.89 | SMO (0.55) | SMODRD4SSTR5SSTR1HRH1 |
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-9512106-B2 | Smoothened modulators and methods of use thereof | DUKE UNIVERSITY (US) | 2016-12-06 | — | — | US | disclosed |