Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | PDE5A | O76074 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | PDE4A | P27815 | 4/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4967088 | 0.86 | PDE4D (0.45) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4966844 | 0.86 | PDE4D (0.45) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL1253373 | 0.82 | MAPT (0.44) | MAPTHTTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL4967215 | 0.81 | HSD17B10 (0.47) | MAPTHTTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL4966210 | 0.81 | KMT2A (0.41) | POLBMAPTKMT2AMEN1 | |
| SCHEMBL4965902 | 0.81 | ADRB2 (0.46) | MAPTHTTSMN1; SMN2KMT2AADRB2 | |
| SCHEMBL4968303 | 0.79 | MAPT (0.41) | MAPTHTTSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL4969129 | 0.77 | PDE5A (0.41) | POLBPDE5AMAPTHTTSMN1; SMN2 | |
| SCHEMBL1252278 | 0.76 | MAPT (0.47) | POLBMAPTHTTSMN1; SMN2KMT2A | |
| SCHEMBL4969708 | 0.75 | MAPT (0.44) | POLBMAPTHTTSMN1; SMN2KMT2A |
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-2008101938-A1 | GLUCOPYRANOSYL-SUBSTITUTED BENZYL-BENZONITRILE DERIVATIVES, MEDICAMENTS CONTAINING SUCH COMPOUNDS, THEIR USE AND PROCESS FOR THEIR MANUFACTURE | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-08-28 | — | — | WO | disclosed |
| WO-2008101938-A1 | GLUCOPYRANOSYL-SUBSTITUTED BENZYL-BENZONITRILE DERIVATIVES, MEDICAMENTS CONTAINING SUCH COMPOUNDS, THEIR USE AND PROCESS FOR THEIR MANUFACTURE | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-08-28 | — | — | WO | disclosed |