Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3303451 | 1.00 | NPSR1 (0.35) | NPSR1KDM4ESIRT2THRBRXFP1 | |
| SCHEMBL3583782 | 0.91 | RXFP1 (0.35) | KDM4ESIRT2RXFP1MRGPRX4ALDH1A1 | |
| SCHEMBL3583786 | 0.91 | RXFP1 (0.35) | KDM4ESIRT2RXFP1MRGPRX4ALDH1A1 | |
| SCHEMBL15310560 | 0.91 | NPSR1 (0.34) | NPSR1KDM4ESIRT2THRBRXFP1 | |
| SCHEMBL3297317 | 0.91 | NPSR1 (0.34) | NPSR1KDM4ESIRT2THRBRXFP1 | |
| SCHEMBL1563909 | 0.90 | SIRT2 (0.37) | NPSR1KDM4ESIRT2THRBRXFP1 | |
| SCHEMBL3303426 | 0.85 | S1PR1 (0.35) | KDM4ESIRT2RXFP1MRGPRX4ALDH1A1 | |
| SCHEMBL3303434 | 0.85 | S1PR1 (0.35) | KDM4ESIRT2RXFP1MRGPRX4ALDH1A1 | |
| SCHEMBL1455821 | 0.84 | THRB (0.41) | NPSR1KDM4ESIRT2THRBMRGPRX4 | |
| SCHEMBL3302985 | 0.83 | S1PR1 (0.37) | KDM4ESIRT2RXFP1ALDH1A1HPGD |
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-2058317-B1 | AMINOPHOSPHORIC ACID ESTER DERIVATIVE AND S1P RECEPTOR MODULATOR CONTAINING THE SAME AS ACTIVE INGREDIENT | KYORIN SEIYAKU KK (JP) | 2013-10-16 | — | — | EP | disclosed |