Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.35 |
| ▸ | DCK | P27707 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 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 | |
|---|---|---|---|---|
| SCHEMBL8243215 | 0.77 | GPBAR1 (0.43) | ADORA2AADORA1HTR7TSHR | |
| SCHEMBL4336601 | 0.69 | DHODH (0.44) | KDM4ETRPM8 | |
| SCHEMBL13615450 | 0.64 | TRPM8 (0.53) | KDM4EMEN1MAPTKMT2ATRPM8 | |
| SCHEMBL9954155 | 0.64 | ADORA2A (0.48) | ADORA2AADORA1DCKKDM4ENISCH | |
| SCHEMBL2092341 | 0.63 | ADORA2A (0.46) | ADORA2AADORA1KDM4ECHRNB4CHRNA3 | |
| SCHEMBL2093695 | 0.63 | ALDH1A1 (0.46) | ADORA2AADORA1DCKKDM4ENISCH | |
| SCHEMBL8249375 | 0.63 | HTR7 (0.43) | HTR7NISCHTSHRCLK4 | |
| SCHEMBL9955117 | 0.62 | ADORA2A (0.41) | ADORA2AADORA1KDM4ECHRNB4CHRNA3 | |
| SCHEMBL8250249 | 0.61 | PTGS1 (0.57) | HTR7MAPTALDH1A1CYP1A2 | |
| SCHEMBL13002810 | 0.60 | MGAM (0.44) | ADORA2AADORA1KDM4EMEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-7612069-B2 | Acyl guanidines as beta-secretase inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-11-03 | — | — | US | disclosed |
| WO-2007002214-A2 | ACYL GUANIDINES AS BETA-SECRETASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-01-04 | — | — | WO | disclosed |