Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 10/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 9/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.55 |
| ▸ | ADRB3 | P13945 | 5/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.54 |
| ▸ | HTR2B | P41595 | 3/20 | 0.54 |
| ▸ | NR2E1 | Q9Y466 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | HTR2A | P28223 | 3/20 | 0.54 |
| ▸ | HTR2C | P28335 | 3/20 | 0.54 |
| ▸ | HTR6 | P50406 | 3/20 | 0.54 |
| ▸ | SCN1A | P35498 | 2/20 | 0.54 |
| ▸ | SLC10A1 | Q14973 | 2/20 | 0.54 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.54 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | HTR1A | P08908 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL8945016 | 0.76 | FAAH (0.56) | ADRB1CYP2D6CYP1A2SLC6A4HTR2B | |
| SCHEMBL11623257 | 0.75 | ADRB2 (0.66) | ADRB2ADRB1CYP2D6ADRB3SIGMAR1 | |
| SCHEMBL11628396 | 0.74 | ADRB2 (0.48) | ADRB2ADRB1CYP2D6ADRB3SIGMAR1 | |
| SCHEMBL8945065 | 0.74 | FAAH (0.54) | CYP2D6CYP1A2SMN1; SMN2LMNAKCNH2 | |
| SCHEMBL11767962 | 0.74 | ADRB2 (0.58) | ADRB2ADRB1CYP2D6ADRB3SIGMAR1 | |
| SCHEMBL11153762 | 0.73 | ADRB2 (0.56) | ADRB2ADRB1CYP2D6ADRB3SIGMAR1 | |
| Hydrochloric Acid SCHEMBL8945374 | 0.73 | FAAH (0.52) | CYP2D6CYP1A2SMN1; SMN2LMNAKCNH2 | |
| SCHEMBL11868102 | 0.73 | ADRB2 (0.82) | ADRB2ADRB1CYP2D6ADRB3SIGMAR1 | |
| SCHEMBL8945055 | 0.72 | FAAH (0.51) | LMNAFAAHMGLL | |
| 4-Hydroxypropranolol Sulfate SCHEMBL28716845 | 0.72 | CYP2D6 (0.72) | ADRB2ADRB1CYP2D6ADRB3SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-52031070-A | — | — | None | — | — | JP | disclosed |
| JP-S5231070-A | 1,2-BENZISOOXAZOLE DRIVATIVES | SHIONOGI & CO LTD | 1977-03-09 | — | — | JP | disclosed |