Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 8/20 | 0.68 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.68 |
| ▸ | ADRB3 | P13945 | 5/20 | 0.68 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | MTOR | P42345 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL2760850 | 0.83 | ADRA2A (0.66) | ADRB1ADRB2ADRB3MAPTMTOR | |
| SCHEMBL11851290 | 0.81 | ADRB2 (1.00) | ADRB1ADRB2ADRB3MAPTMTOR | |
| SCHEMBL11852515 | 0.81 | ADRB2 (0.68) | ADRB1ADRB2ADRB3MAPTMTOR | |
| SCHEMBL11841871 | 0.79 | ADRB2 (0.56) | ADRB1ADRB2HIF1ATSHRTDP1 | |
| SCHEMBL11849771 | 0.76 | ADRB2 (0.52) | ADRB1ADRB2ADRB3KDM4EADRA1A | |
| SCHEMBL2250 | 0.75 | ADRA2A (0.61) | ADRB1ADRB2ADRB3MAPTHIF1A | |
| SCHEMBL11848941 | 0.73 | ADRB2 (0.66) | ADRB1ADRB2ADRB3MAPTMTOR | |
| SCHEMBL10790009 | 0.73 | ADRB2 (0.58) | ADRB1ADRB2ADRB3MAPTMTOR | |
| SCHEMBL12380944 | 0.73 | GABRA1 (0.46) | ADRB1ADRB2ADRB3HIF1ATSHR | |
| Hydrochloric Acid SCHEMBL11848932 | 0.72 | ADRB2 (0.64) | ADRB1ADRB2ADRB3MAPTMTOR |
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-3976695-A | Halogen substituted α-(aminoalkyl)-3,4-dihydroxybenzyl alcohols | SMITHKLINE CORPORATION (US) | 1976-08-24 | — | — | US | claimed |
| US-3976695-A | Halogen substituted α-(aminoalkyl)-3,4-dihydroxybenzyl alcohols | SMITHKLINE CORPORATION (US) | 1976-08-24 | — | — | US | disclosed |