Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 17/20 | 0.54 |
| ▸ | CASP3 | P42574 | 1/20 | 0.54 |
| ▸ | CASP6 | P55212 | 1/20 | 0.54 |
| ▸ | ADRB1 | P08588 | 6/20 | 0.50 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 5/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.49 |
| ▸ | DRD2 | P14416 | 3/20 | 0.49 |
| ▸ | MTOR | P42345 | 2/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11873887 | 0.91 | ADRB2 (0.60) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL11875004 | 0.89 | ADRB2 (0.58) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL10662739 | 0.86 | ADRB3 (0.54) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL7154315 | 0.84 | ADRB2 (0.68) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL7154320 | 0.84 | ADRB2 (0.68) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL11881488 | 0.83 | ADRB3 (0.64) | ADRB2ADRB1ADRB3ADRA1AADRA1D | |
| SCHEMBL8986831 | 0.77 | ADRB2 (0.68) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL2455273 | 0.77 | ADRB2 (0.78) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL29899656 | 0.77 | ADRB2 (0.78) | ADRB2CASP3CASP6ADRB1ADRB3 | |
| SCHEMBL11174404 | 0.76 | ADRB2 (0.61) | ADRB2CASP3CASP6ADRB1ADRB3 |
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-3961076-A | BRONCHODILATORS | SMITHKLINE CORPORATION (US) | 1976-06-01 | — | — | US | disclosed |