Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 17/20 | 0.71 |
| ▸ | ADRB1 | P08588 | 15/20 | 0.71 |
| ▸ | ADRA1D | P25100 | 7/20 | 0.71 |
| ▸ | ADRA1A | P35348 | 7/20 | 0.71 |
| ▸ | ADRA1B | P35368 | 7/20 | 0.71 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.71 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.71 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.71 |
| ▸ | LMNA | P02545 | 2/20 | 0.71 |
| ▸ | HPGD | P15428 | 2/20 | 0.71 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.71 |
| ▸ | HTR1A | P08908 | 1/20 | 0.71 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.71 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.71 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.71 |
| ▸ | DRD3 | P35462 | 1/20 | 0.71 |
| ▸ | HTR2B | P41595 | 1/20 | 0.71 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.71 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL11560731 | 0.91 | ADRB2 (0.75) | ADRB2ADRB1ADRA1DADRA1AADRA1B | |
| SCHEMBL11564848 | 0.88 | ADRB2 (0.71) | ADRB2ADRB1ADRA1DADRA1AADRA1B | |
| SCHEMBL11571050 | 0.87 | ADRB1 (0.70) | ADRB2ADRB1ADRA1DADRA1AADRA1B | |
| SCHEMBL7208694 | 0.85 | ADRB2 (0.80) | ADRB2ADRB1ADRA1DADRA1AADRA1B | |
| SCHEMBL7208690 | 0.85 | ADRB2 (0.80) | ADRB2ADRB1ADRA1DADRA1AADRA1B | |
| SCHEMBL10883901 | 0.85 | ADRB2 (0.72) | ADRB2ADRB1ADRA1DADRA1AADRA1B | |
| SCHEMBL3719343 | 0.85 | ADRB2 (0.72) | ADRB2ADRB1ADRA1DADRA1AADRA1B | |
| Labetalol SCHEMBL10882744 | 0.83 | ADRB1 (1.00) | ADRB2ADRB1ADRA1DADRA1AADRA1B | |
| Labetalol SCHEMBL4582 | 0.83 | ADRB1 (1.00) | ADRB2ADRB1ADRA1DADRA1AADRA1B | |
| Dilevalol SCHEMBL79468 | 0.83 | ADRB1 (1.00) | ADRB2ADRB1ADRA1DADRA1AADRA1B |
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-4163053-A | Anti-hypertensive 5-[2-(substituted anilinoalkylamino)-1-hydroxyalkyl]salicylamides | SCHERING CORPORATION (US) | 1979-07-31 | — | — | US | disclosed |
| EP-0002867-A1 | 5-(2-Anilinoalkylamino-1-hydroxyalkyl)salicylamides, their preparation and anti-hypertensive compositions containing them | Technobiotic Ltd. (CH) | 1979-07-11 | — | — | EP | disclosed |