Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 5/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CETP | P11597 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | GMNN | O75496 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | THPO | P40225 | 1/20 | 0.55 |
| ▸ | MTOR | P42345 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | UBE2N | P61088 | 1/20 | 0.55 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ASAH1 | Q13510 | 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 | |
|---|---|---|---|---|
| SCHEMBL21636787 | 1.00 | SPHK1 (0.55) | SPHK1CYP2D6CETPLMNAGMNN | |
| SCHEMBL21428085 | 1.00 | SPHK1 (0.55) | SPHK1CYP2D6CETPLMNAGMNN | |
| Hydrochloric Acid SCHEMBL7612591 | 0.98 | SPHK1 (0.53) | SPHK1CYP2D6CETPLMNAGMNN | |
| SCHEMBL1630183 | 0.98 | SPHK1 (0.52) | SPHK1CYP2D6CETPLMNAGMNN | |
| SCHEMBL4145583 | 0.83 | LMNA (0.48) | SPHK1CYP2D6CETPLMNAGMNN | |
| Ammonia Solution, Strong SCHEMBL27688807 | 0.82 | SPHK1 (0.48) | SPHK1CYP2D6CETPLMNAGMNN | |
| SCHEMBL21636792 | 0.82 | SPHK1 (0.52) | SPHK1CYP2D6CETPLMNAGMNN | |
| SCHEMBL21428147 | 0.80 | SPHK1 (0.49) | SPHK1CYP2D6CETPLMNAGMNN | |
| Phosphoric Acid SCHEMBL10482628 | 0.79 | PTPN1 (0.50) | SPHK1CYP2D6CETPLMNAGMNN | |
| SCHEMBL10441289 | 0.77 | SPHK1 (0.54) | SPHK1CYP2D6CETPLMNAGMNN |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111448196-A | Folates for medical use | 阿普罗福尔公司 | 2020-07-24 | — | — | CN | disclosed |
| EP-2794576-A1 | NON-SYSTEMIC TGR5 AGONISTS | Ardelyx, Inc. (US) | 2014-10-29 | — | — | EP | disclosed |
| WO-2013096771-A1 | NON-SYSTEMIC TGR5 AGONISTS | ARDELYX, INC. (US) | 2013-06-27 | — | — | WO | disclosed |