Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 3/20 | 0.53 |
| ▸ | HTR1A | P08908 | 3/20 | 0.46 |
| ▸ | HTR3A | P46098 | 3/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | AHR | P35869 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 4/20 | 0.41 |
| ▸ | HTR7 | P34969 | 6/20 | 0.41 |
| ▸ | HTR2A | P28223 | 2/20 | 0.41 |
| ▸ | HTR5A | P47898 | 2/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.39 |
| ▸ | HTR3B | O95264 | 1/20 | 0.39 |
| ▸ | HTR3D | Q70Z44 | 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 | |
|---|---|---|---|---|
| SCHEMBL6629232 | 0.88 | ADRB1 (0.53) | ADRB1HTR1AHTR3ADRD2DRD3 | |
| SCHEMBL7248902 | 0.78 | ADRB1 (0.43) | ADRB1HTR1AHTR3ADRD2DRD3 | |
| SCHEMBL6651477 | 0.76 | ADRB1 (0.47) | ADRB1HTR1AHTR3A | |
| SCHEMBL7805793 | 0.75 | GAA (0.46) | ADRB1HTR1ADRD2DRD3ALDH1A1 | |
| SCHEMBL6782999 | 0.73 | ADRB1 (0.53) | ADRB1AHRALDH1A1CYP3A4LMNA | |
| SCHEMBL25870816 | 0.72 | ADRB1 (0.41) | ADRB1HTR3ADRD2DRD3ALDH1A1 | |
| SCHEMBL6629435 | 0.72 | ADORA3 (0.46) | ADRB1ALDH1A1CYP3A4MEN1LMNA | |
| SCHEMBL7242984 | 0.71 | HTT (0.49) | ADRB1HTR1AHTR3ADRD2DRD3 | |
| SCHEMBL459418 | 0.70 | ADRB1 (0.52) | ADRB1HTR1AHTR3ADRD2DRD3 | |
| SCHEMBL6128549 | 0.70 | ALDH1A1 (0.68) | ADRB1HTR1AHTR3ADRD2DRD3 |
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-20030095958-A1 | Inhibitors of bace | VERTEX PHARMACEUTICALS INCORPORATED | 2003-05-22 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20030095958-A1 | Inhibitors of bace | BACE2, BACE1, APP | ADRB1 3834/4885HTR1A 4154/4885HTR3A 4232/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.