Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.46 |
| ▸ | TNF | P01375 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | DRD1 | P21728 | 2/20 | 0.43 |
| ▸ | DRD4 | P21917 | 2/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8906035 | 0.87 | OPRK1 (0.44) | ALDH1A1KDM4EGAAMAPTMAPK1 | |
| SCHEMBL11102216 | 0.83 | MEN1 (0.59) | ALDH1A1KDM4EADRB2DRD2DRD1 | |
| SCHEMBL8907016 | 0.81 | ADRB2 (0.51) | ALDH1A1KDM4EGAAMAPTADRB2 | |
| SCHEMBL11099823 | 0.80 | ADRB2 (0.50) | ALDH1A1MAPK1ADRB2DRD2DRD1 | |
| SCHEMBL11098569 | 0.80 | OPRK1 (0.54) | ALDH1A1MAPTHTTADRB2DRD2 | |
| SCHEMBL8907092 | 0.80 | MEN1 (0.55) | ALDH1A1GAAMAPTL3MBTL1HTT | |
| SCHEMBL8905807 | 0.78 | OPRK1 (0.48) | ALDH1A1ADRB2DRD2DRD1DRD4 | |
| SCHEMBL8993333 | 0.78 | ALDH1A1 (0.48) | ALDH1A1KDM4EGAAMAPK1ADRB2 | |
| SCHEMBL11099951 | 0.77 | ADRB2 (0.61) | ALDH1A1ADRB2DRD2DRD1DRD4 | |
| SCHEMBL4916965 | 0.76 | POLB (0.53) | ALDH1A1KDM4EGAAMAPTMAPK1 |
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-4340600-A | Renal dilating methods and compositions using 4-(3,4-dihydroxyphenyl)-1,2,3,4-tetrahydroisoquinolines | SMITHKLINE CORPORATION (US) | 1982-07-20 | — | — | US | disclosed |