Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 4/20 | 0.57 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL16719312 | 0.92 | S1PR1 (0.53) | S1PR1FFAR1FFAR4CD274FOLH1 | |
| SCHEMBL16719303 | 0.89 | S1PR1 (0.58) | S1PR1FFAR1NPSR1KDM4ES1PR3 | |
| SCHEMBL16719290 | 0.87 | S1PR1 (0.60) | S1PR1NPSR1KDM4ES1PR2S1PR3 | |
| SCHEMBL16731831 | 0.82 | S1PR1 (0.47) | S1PR1CD274NPSR1KDM4EHTT | |
| SCHEMBL9909374 | 0.81 | S1PR1 (0.66) | S1PR1FFAR1FFAR4FOLH1 | |
| SCHEMBL15193302 | 0.81 | S1PR1 (0.73) | S1PR1NPSR1KDM4ES1PR3 | |
| SCHEMBL16719311 | 0.80 | S1PR1 (0.56) | S1PR1S1PR2S1PR3LPAR2 | |
| SCHEMBL9909372 | 0.80 | S1PR1 (0.64) | S1PR1FFAR1FFAR4CD274FOLH1 | |
| SCHEMBL16719388 | 0.79 | S1PR1 (0.41) | S1PR1S1PR2S1PR3LPAR2S1PR5 | |
| SCHEMBL16719323 | 0.79 | S1PR1 (0.46) | S1PR1NPSR1KDM4EHTTS1PR3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015073556-A1 | DISUBSTITUTED PHENOXY DERIVATIVES AS SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR MODULATORS | ALLERGAN, INC. (US) | 2015-05-21 | — | — | WO | claimed |
| WO-2015073556-A1 | DISUBSTITUTED PHENOXY DERIVATIVES AS SPHINGOSINE-1-PHOSPHATE (S1P) RECEPTOR MODULATORS | ALLERGAN, INC. (US) | 2015-05-21 | — | — | WO | disclosed |