Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.58 |
| ▸ | HTT | P42858 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.58 |
| ▸ | LTA4H | P09960 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.56 |
| ▸ | EBP | Q15125 | 4/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.54 |
| ▸ | ESR1 | P03372 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Tribromoethanol SCHEMBL11621823 | 0.94 | CYP2D6 (0.52) | CYP2D6HTTCYP1A2CYP2C9LTA4H | |
| Fumaric Acid SCHEMBL11622225 | 0.91 | BCHE (0.55) | CYP2D6HTTCYP1A2CYP2C9LTA4H | |
| SCHEMBL16910242 | 0.88 | SIGMAR1 (0.69) | CYP2D6HTTCYP1A2CYP2C9LTA4H | |
| SCHEMBL10878286 | 0.87 | EBP (0.72) | CYP2D6HTTCYP1A2CYP2C9LTA4H | |
| SCHEMBL10880656 | 0.87 | EBP (0.55) | CYP2D6HTTCYP1A2CYP2C9LTA4H | |
| SCHEMBL10877202 | 0.86 | EBP (0.49) | CYP2D6HTTCYP1A2CYP2C9LTA4H | |
| SCHEMBL10878610 | 0.86 | EBP (0.57) | CYP2D6HTTCYP1A2CYP2C9LTA4H | |
| SCHEMBL10879788 | 0.84 | KMT2A (0.53) | CYP2D6HTTCYP1A2CYP2C9LTA4H | |
| SCHEMBL10893666 | 0.84 | EBP (0.52) | CYP2D6HTTCYP1A2CYP2C9LTA4H | |
| SCHEMBL330094 | 0.83 | SIGMAR1 (0.67) | CYP2D6HTTCYP1A2CYP2C9LTA4H |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0112587-B1 | DERIVATIVES OF 4-(1-(PHENYL)-1-(HYDROXY)-PROP-1-YL)-RESORCINE, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS | RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) | 1990-09-19 | — | — | EP | disclosed |
| EP-0112588-B1 | 4-HYDROXY-ALPHA-ETHYL BENZHYDROLES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS | RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) | 1987-11-11 | — | — | EP | disclosed |
| US-4094908-A | Alpha-substituted benzhydrol derivatives | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1978-06-13 | — | — | US | disclosed |
| US-4039589-A | LIVER MICROSOMAL ENZYMES | RICHTER GEDEON VEGYESZETI GYAR RT. (HU) | 1977-08-02 | — | — | US | disclosed |