Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 16/20 | 0.61 |
| ▸ | SPHK2 | Q9NRA0 | 10/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | SHBG | P04278 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | TACR2 | P21452 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8963211 | 1.00 | SPHK1 (0.61) | SPHK1SPHK2KDM4EALDH1A1LMNA | |
| SCHEMBL8962926 | 0.96 | SPHK1 (0.55) | SPHK1SPHK2 | |
| SCHEMBL8962920 | 0.96 | SPHK1 (0.55) | SPHK1SPHK2 | |
| SCHEMBL9450903 | 0.91 | SPHK1 (0.52) | SPHK1SPHK2 | |
| SCHEMBL8963144 | 0.90 | SPHK1 (0.47) | SPHK1SPHK2 | |
| SCHEMBL8963157 | 0.90 | SPHK1 (0.47) | SPHK1SPHK2 | |
| SCHEMBL7561699 | 0.86 | SPHK1 (0.61) | SPHK1SPHK2 | |
| SCHEMBL9476764 | 0.86 | SPHK1 (0.61) | SPHK1SPHK2KDM4EALDH1A1LMNA | |
| SCHEMBL8962913 | 0.86 | SPHK1 (0.43) | SPHK1SPHK2 | |
| SCHEMBL8963029 | 0.86 | SPHK1 (0.43) | SPHK1SPHK2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0559860-B1 | HALOVINYL-DERIVATIVES | HOFFMANN LA ROCHE (CH) | 1996-02-14 | — | — | EP | disclosed |
| US-5364556-A | Halovinyl-derivatives | HOFFMANN-LA ROCHE INC. (US) | 1994-11-15 | — | — | US | disclosed |