Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 4/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | CFTR | P13569 | 1/20 | 0.35 |
| ▸ | IDH1 | O75874 | 1/20 | 0.34 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.33 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3556370 | 0.70 | CFTR (0.43) | S1PR1S1PR3CFTRIDH1LTA4H | |
| SCHEMBL3884188 | 0.65 | QPCT (0.35) | HDAC8 | |
| SCHEMBL4037907 | 0.63 | QPCT (0.43) | — | |
| SCHEMBL4430768 | 0.63 | TSHR (0.59) | CFTRIDH1SLC5A2 | |
| SCHEMBL1602448 | 0.62 | S1PR1 (0.67) | S1PR1S1PR3CFTRIDH1LTA4H | |
| SCHEMBL4553559 | 0.61 | QPCT (0.51) | HDAC1HDAC8HDAC6HDAC5 | |
| SCHEMBL11576495 | 0.60 | TSHR (0.52) | IDH1LTA4HCHRNB4CHRNA3HDAC8 | |
| SCHEMBL1280879 | 0.59 | LTC4S (0.53) | HDAC1HDAC8HDAC6 | |
| SCHEMBL3362040 | 0.58 | CALM1 (0.55) | IDH1LTA4H | |
| SCHEMBL9560915 | 0.58 | BCL2 (0.47) | CFTRIDH1SLC5A2 |
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-2010524-A2 | S1P RECEPTOR MODULATING COMPOUNDS | Epix Delaware, Inc. (US) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007109330-A2 | S1P RECEPTOR MODULATING COMPOUNDS | EPIX DELAWARE, INC. (US) | 2007-09-27 | — | — | WO | disclosed |