Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.44 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.41 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.41 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | EBP | Q15125 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21122862 | 0.92 | ABCB1 (0.46) | HRH3SIGMAR1L3MBTL3L3MBTL1EBP | |
| SCHEMBL24045454 | 0.89 | HRH1 (0.47) | HRH3SIGMAR1KCNH2SMN1; SMN2L3MBTL3 | |
| SCHEMBL16596049 | 0.76 | SLC6A4 (0.48) | HRH3SIGMAR1KCNH2L3MBTL3L3MBTL1 | |
| SCHEMBL16695091 | 0.76 | CSNK2A1 (0.53) | HRH3SIGMAR1KCNH2TMEM97 | |
| SCHEMBL18634962 | 0.74 | ALDH1A1 (0.40) | SMN1; SMN2PDE4BMAPTCRHBPCRHR2 | |
| SCHEMBL19904416 | 0.74 | ABCB1 (0.44) | HRH3SIGMAR1KCNH2L3MBTL3L3MBTL1 | |
| SCHEMBL16595882 | 0.73 | SLC6A4 (0.51) | HRH3SIGMAR1KCNH2L3MBTL3L3MBTL1 | |
| SCHEMBL16595899 | 0.73 | CSNK2A1 (0.53) | HRH3SIGMAR1KCNH2TMEM97 | |
| SCHEMBL19904479 | 0.73 | HRH3 (0.45) | HRH3SIGMAR1KCNH2EBPTMEM97 | |
| SCHEMBL19904403 | 0.72 | ALDH1A1 (0.36) | KCNH2SMN1; SMN2PDE4BMAPTCRHBP |
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 |
|---|---|---|---|---|---|---|---|
| EP-3063141-B1 | N-(1-HYDROXY-3-(PYRROLIDINYL)PROPAN-2-YL)PYRROLIDINE-3-CARBOXAMIDE DERIVATIVES AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS | BIOMARIN PHARM INC (US) | 2018-02-28 | — | — | EP | disclosed |