Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 14/20 | 0.80 |
| ▸ | ADRB1 | P08588 | 7/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 7/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.64 |
| ▸ | ADRA1A | P35348 | 6/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.64 |
| ▸ | LMNA | P02545 | 5/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.64 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.64 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.64 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.64 |
| ▸ | TSHR | P16473 | 4/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.64 |
| ▸ | DRD3 | P35462 | 3/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.64 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.64 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.64 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.64 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.64 |
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 | |
|---|---|---|---|---|
| Butopamine SCHEMBL122463 | 0.89 | ADRB2 (1.00) | ADRB2ADRB1MAPK1ADRA1AHSD17B10 | |
| Ractopamine SCHEMBL9757702 | 0.89 | ADRB2 (1.00) | ADRB2ADRB1MAPK1ADRA1AHSD17B10 | |
| Ractopamine SCHEMBL10659583 | 0.89 | ADRB2 (1.00) | ADRB2ADRB1MAPK1ADRA1AHSD17B10 | |
| Ractopamine SCHEMBL144797 | 0.89 | ADRB2 (1.00) | ADRB2ADRB1MAPK1ADRA1AHSD17B10 | |
| Ractopamine SCHEMBL8851800 | 0.88 | ADRB2 (0.97) | ADRB2ADRB1MAPK1KDM4EADRA1A | |
| Ractopamine SCHEMBL350754 | 0.88 | ADRB2 (0.97) | ADRB2ADRB1MAPK1KDM4EADRA1A | |
| Butopamine SCHEMBL11471316 | 0.88 | ADRB2 (0.97) | ADRB2ADRB1MAPK1ADRA1AHSD17B10 | |
| Ractopamine SCHEMBL11471317 | 0.88 | ADRB2 (0.97) | ADRB2ADRB1MAPK1ADRA1AHSD17B10 | |
| Butopamine SCHEMBL351104 | 0.88 | ADRB2 (0.97) | ADRB2ADRB1MAPK1KDM4EADRA1A | |
| Ractopamine SCHEMBL8892153 | 0.88 | ADRB2 (0.97) | ADRB2ADRB1MAPK1KDM4EADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0658538-B1 | Diagnosis, evaluation and treatment of coronary artery disease by exercise simulation using closed loop drug delivery of an exercise simulating agent beta agonist | GENSIA INC (US) | 1997-10-29 | — | — | EP | disclosed |