Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 14/20 | 0.51 |
| ▸ | S1PR5 | Q9H228 | 13/20 | 0.51 |
| ▸ | S1PR4 | O95977 | 12/20 | 0.51 |
| ▸ | S1PR3 | Q99500 | 9/20 | 0.51 |
| ▸ | PLK1 | P53350 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | NISCH | Q9Y2I1 | 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 | |
|---|---|---|---|---|
| SCHEMBL13598152 | 0.84 | S1PR1 (0.52) | S1PR1S1PR5S1PR4S1PR3MAOA | |
| Hydrochloric Acid SCHEMBL3901527 | 0.83 | S1PR1 (0.51) | S1PR1S1PR5S1PR4S1PR3MAOA | |
| SCHEMBL13958224 | 0.82 | S1PR1 (0.49) | S1PR1S1PR5S1PR4S1PR3PLK1 | |
| Trifluoroacetic Acid SCHEMBL3902745 | 0.79 | S1PR1 (0.54) | S1PR1S1PR5S1PR4S1PR3PLK1 | |
| SCHEMBL13598542 | 0.79 | S1PR1 (0.49) | S1PR1S1PR5S1PR4S1PR3PLK1 | |
| Hydrochloric Acid SCHEMBL3902610 | 0.78 | S1PR1 (0.49) | S1PR1S1PR5S1PR4S1PR3PLK1 | |
| SCHEMBL13598577 | 0.77 | S1PR1 (0.49) | S1PR1S1PR5S1PR4S1PR3PLK1 | |
| Hydrochloric Acid SCHEMBL3898887 | 0.77 | S1PR1 (0.49) | S1PR1S1PR5S1PR4S1PR3PLK1 | |
| SCHEMBL13598220 | 0.76 | S1PR1 (0.43) | S1PR1S1PR5S1PR4S1PR3PLK1 | |
| Hydrochloric Acid SCHEMBL3901642 | 0.75 | S1PR1 (0.42) | S1PR1S1PR5S1PR4S1PR3PLK1 |
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-2017263-A1 | HETEROARYLAMIDE LOWER CARBOXYLIC ACID DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2009-01-21 | — | — | EP | disclosed |