Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 3/20 | 0.51 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.51 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.51 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.51 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.41 |
| ▸ | KHK | P50053 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11825425 | 0.87 | CHRM3 (0.50) | PDE4APDE4BPDE4CPDE4DCHRM3 | |
| SCHEMBL11835714 | 0.87 | CHRM3 (0.50) | PDE4APDE4BPDE4CPDE4DCHRM3 | |
| Hydrochloric Acid SCHEMBL11835748 | 0.86 | CHRM3 (0.49) | PDE4APDE4BPDE4CPDE4DCHRM3 | |
| SCHEMBL11825078 | 0.79 | KMT2A (0.67) | PDE4APDE4BPDE4CPDE4DCHRM3 | |
| SCHEMBL11828639 | 0.77 | ALDH1A1 (0.57) | ALDH1A1KMT2ACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11828142 | 0.74 | HTR2A (0.41) | ALDH1A1CYP1A2CYP2C9CYP2C19TDP1 | |
| SCHEMBL11826765 | 0.73 | CHRM3 (0.48) | PDE4APDE4BPDE4CPDE4DCHRM3 | |
| SCHEMBL11829172 | 0.72 | HTR2A (0.42) | ALDH1A1CYP1A2CYP2C9CYP2C19MAPT | |
| SCHEMBL11823112 | 0.72 | MAPT (0.41) | ALDH1A1KMT2AMEN1CYP1A2CYP2C9 | |
| SCHEMBL11824715 | 0.72 | MAPT (0.41) | ALDH1A1KMT2AMEN1CYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-3975384-A | ANTITHROMBOTICS | BOEHRINGER INGELHEIM GMBH (DT) | 1976-08-17 | — | — | US | disclosed |