Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 10/20 | 0.52 |
| ▸ | S1PR3 | Q99500 | 6/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | CHKA | P35790 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1602190 | 0.86 | S1PR1 (0.71) | S1PR1S1PR3KCNH2 | |
| SCHEMBL1602087 | 0.83 | S1PR1 (0.61) | S1PR1S1PR3KCNH2 | |
| SCHEMBL3706283 | 0.80 | S1PR1 (0.60) | S1PR1S1PR3KCNH2MAOBCHKA | |
| SCHEMBL2415217 | 0.80 | S1PR1 (0.53) | S1PR1S1PR3KCNH2MAOBMAOA | |
| SCHEMBL3772064 | 0.78 | S1PR1 (0.53) | S1PR1S1PR3KCNH2MAOBCHKA | |
| SCHEMBL1601723 | 0.76 | S1PR1 (0.73) | S1PR1S1PR3KCNH2 | |
| SCHEMBL3767702 | 0.75 | S1PR1 (0.56) | S1PR1S1PR3KCNH2MAOBCHKA | |
| SCHEMBL1602358 | 0.75 | S1PR1 (0.74) | S1PR1S1PR3KCNH2 | |
| SCHEMBL12269426 | 0.75 | S1PR1 (0.74) | S1PR1S1PR3KCNH2 | |
| SCHEMBL12269470 | 0.73 | S1PR1 (0.62) | S1PR1S1PR3KCNH2MAOB |
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 |
|---|---|---|---|---|---|---|---|
| JP-2010522162-A | — | — | 2010-07-01 | — | — | JP | claimed |
| EP-2121648-A2 | S1P RECEPTOR MODULATING COMPOUNDS AND USE THEREOF | EPIX Pharmaceuticals, Inc. (US) | 2009-11-25 | — | — | EP | claimed |
| WO-2007109334-A2 | SIP RECEPTOR MODULATING COMPOUNDS AND USE THEREOF | EPIX DELAWARE, INC. (US) | 2007-09-27 | — | — | WO | claimed |