Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 6/20 | 0.41 |
| ▸ | APP | P05067 | 2/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL10791688 | 0.77 | ADRB2 (0.57) | ADRB2ADRB1ADRB3CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL10791450 | 0.76 | ADRB2 (0.56) | ADRB2ADRB1ADRB3CYP1A2CYP2D6 | |
| SCHEMBL5825018 | 0.75 | POLB (0.58) | ESR1CYP19A1ESR2POLBDRD4 | |
| Hydrochloric Acid SCHEMBL10792415 | 0.74 | CASR (0.44) | POLBDRD4 | |
| SCHEMBL320679 | 0.74 | ADRB2 (0.54) | ESR1CYP19A1ESR2MAOBAPP | |
| SCHEMBL3618029 | 0.73 | MAOB (0.69) | MAOBAPPNR4A2PARP10CYP1A2 | |
| SCHEMBL11601115 | 0.73 | MAOB (0.69) | MAOBAPPNR4A2PARP10CYP1A2 | |
| SCHEMBL9114592 | 0.71 | CYP1A2 (0.63) | MAOBAPPDRD4CYP1A2CYP2D6 | |
| SCHEMBL226548 | 0.71 | LTA4H (0.64) | ESR1CYP19A1ESR2APPDRD4 | |
| Hydrochloric Acid SCHEMBL7377876 | 0.71 | DRD4 (0.55) | MAOBADRB2ADRB1ADRB3DRD4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0041233-B1 | SUBSTITUTED PHENOXY-AMINOPROPANOL DERIVATIVES, INTERMEDIATES AND PROCESSES FOR THEIR PRODUCTION, AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1984-02-15 | — | — | EP | claimed |