Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.56 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.56 |
| ▸ | HTR1A | P08908 | 3/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.55 |
| ▸ | MAOA | P21397 | 1/20 | 0.55 |
| ▸ | HTR2B | P41595 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | DRD1 | P21728 | 1/20 | 0.52 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Fumaric Acid SCHEMBL7312424 | 0.92 | ADRB2 (0.51) | MAPTADRB2ADRB1HTR1AADRA2A | |
| SCHEMBL11197660 | 0.89 | MAPT (0.64) | MAPTADRB2ADRB1HTR1AADRA2A | |
| SCHEMBL7313353 | 0.88 | MAPT (0.55) | MAPTADRB2ADRB1HTR1AADRA2A | |
| SCHEMBL7319524 | 0.87 | CASR (0.60) | ADRB2ADRB1CYP2D6SLC6A2SLC6A4 | |
| SCHEMBL7302638 | 0.86 | ALDH1A1 (0.60) | ADRB2ADRB1HTR1AHTR2BCYP2D6 | |
| SCHEMBL11507651 | 0.86 | MAPT (0.61) | MAPTADRB2ADRB1HTR1AADRA2A | |
| SCHEMBL7308129 | 0.86 | MAPT (0.53) | MAPTADRB2ADRB1HTR1AADRA2A | |
| SCHEMBL7317641 | 0.84 | ADRB2 (0.67) | ADRB2ADRB1HTR1AHTR2BCYP2D6 | |
| SCHEMBL7314332 | 0.82 | ADRB2 (0.46) | MAPTADRB2ADRB1HTR1AADRA2A | |
| SCHEMBL7320517 | 0.82 | MAPT (0.59) | MAPTADRB2ADRB1HTR1AADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4258062-A | ISOPRENALINE ANTAGONISTS EFFECTING HEART RATE AND BLOOD PRESSURE | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1981-03-24 | — | — | US | disclosed |
| US-4171370-A | Phenoxy-amino-propanols | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-10-16 | — | — | US | disclosed |