Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.74 |
| ▸ | HTT | P42858 | 2/20 | 0.74 |
| ▸ | LTA4H | P09960 | 2/20 | 0.74 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.74 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.74 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.74 |
| ▸ | EBP | Q15125 | 3/20 | 0.62 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.62 |
| ▸ | ESR1 | P03372 | 3/20 | 0.62 |
| ▸ | DRD3 | P35462 | 3/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.62 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.62 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.62 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.62 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.62 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.62 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.62 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.62 |
| ▸ | HTR6 | P50406 | 2/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL1405290 | 1.00 | CYP2D6 (0.74) | CYP2D6HTTLTA4HCYP1A2CYP2C9 | |
| Bromide SCHEMBL1173547 | 0.98 | CYP2D6 (0.72) | CYP2D6HTTLTA4HCYP1A2CYP2C9 | |
| Hydrochloric Acid SCHEMBL10505479 | 0.98 | CYP2D6 (0.72) | CYP2D6HTTLTA4HCYP1A2CYP2C9 | |
| SCHEMBL6676718 | 0.90 | LTA4H (0.62) | CYP2D6HTTLTA4HCYP1A2CYP2C9 | |
| SCHEMBL9706125 | 0.89 | EBP (0.72) | CYP2D6HTTLTA4HCYP1A2CYP2C9 | |
| SCHEMBL21195812 | 0.87 | KCNA3 (0.64) | CYP2D6HTTLTA4HCYP1A2CYP2C9 | |
| SCHEMBL22224170 | 0.86 | ALDH1A1 (0.63) | CYP2D6HTTLTA4HCYP1A2CYP2C9 | |
| Methylamine SCHEMBL10666826 | 0.86 | LTA4H (0.58) | CYP2D6HTTLTA4HCYP1A2CYP2C9 | |
| SCHEMBL14463907 | 0.86 | LTA4H (0.57) | CYP2D6HTTLTA4HCYP1A2CYP2C9 | |
| SCHEMBL9706141 | 0.86 | KDM4E (0.73) | CYP2D6HTTLTA4HCYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2688878-A1 | PROCESS FOR SYNTHESIZING KETO-BENZOFURAN DERIVATIVES | SANOFI (FR) | 2014-01-29 | — | — | EP | disclosed |
| WO-2012127173-A1 | PROCESS FOR SYNTHESIZING KETO-BENZOFURAN DERIVATIVES | SANOFI (FR) | 2012-09-27 | — | — | WO | disclosed |