Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGKA | P23743 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.45 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.45 |
| ▸ | PAM | P19021 | 2/20 | 0.42 |
| ▸ | NAAA | Q02083 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | DNM1 | Q05193 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL16126196 | 0.93 | DGKA (0.52) | DGKAHTR2CPAMNAAAALDH1A1 | |
| SCHEMBL15129332 | 0.91 | S1PR1 (0.43) | DGKAHTR2CS1PR1S1PR3S1PR4 | |
| SCHEMBL15129331 | 0.84 | DGKA (0.43) | DGKAHTR2CS1PR1S1PR3S1PR4 | |
| SCHEMBL13125515 | 0.83 | DGKA (0.42) | DGKAHTR2CNAAAALDH1A1PRSS1 | |
| SCHEMBL5172684 | 0.81 | ALDH1A1 (0.42) | DGKAHTR2CS1PR1S1PR3S1PR4 | |
| SCHEMBL7393464 | 0.80 | DGKA (0.46) | DGKAHTR2CS1PR1S1PR3S1PR4 | |
| Dibutylsuccinate SCHEMBL28147008 | 0.80 | DGKA (0.57) | DGKAHTR2CPAMNAAAALDH1A1 | |
| SCHEMBL459010 | 0.80 | DGKA (0.57) | DGKAHTR2CPAMNAAAALDH1A1 | |
| SCHEMBL18483446 | 0.80 | DGKA (0.42) | DGKAHTR2CS1PR1S1PR3S1PR4 | |
| SCHEMBL28253752 | 0.79 | DGKA (0.48) | DGKAHTR2CNAAAALDH1A1PRSS1 |
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-20070014727-A1 | Contrast media for nuclear spin tomography with use of the overhauser effect | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2007-01-18 | — | — | US | disclosed |