Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.56 |
| ▸ | CNR1 | P21554 | 1/20 | 0.56 |
| ▸ | ADRB3 | P13945 | 15/20 | 0.56 |
| ▸ | ADRB1 | P08588 | 14/20 | 0.56 |
| ▸ | ADRB2 | P07550 | 12/20 | 0.56 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11655875 | 0.91 | ADRB3 (0.54) | CNR2CNR1ADRB3ADRB1ADRB2 | |
| SCHEMBL11298537 | 0.91 | ADRB3 (0.54) | CNR2CNR1ADRB3ADRB1ADRB2 | |
| SCHEMBL11652084 | 0.91 | ADRB3 (0.54) | CNR2CNR1ADRB3ADRB1ADRB2 | |
| Oxalic Acid SCHEMBL11655462 | 0.89 | ADRB3 (0.52) | CNR2CNR1ADRB3ADRB1ADRB2 | |
| Oxalic Acid SCHEMBL11654026 | 0.89 | ADRB3 (0.52) | CNR2CNR1ADRB3ADRB1ADRB2 | |
| Oxalic Acid SCHEMBL11655003 | 0.89 | ADRB3 (0.52) | CNR2CNR1ADRB3ADRB1ADRB2 | |
| SCHEMBL3761816 | 0.78 | KMT2A (0.59) | CNR2CNR1MEN1KMT2A | |
| SCHEMBL8048083 | 0.78 | BCAT2 (0.62) | CNR2CNR1SLC6A9OPRM1OPRD1 | |
| SCHEMBL16880546 | 0.75 | KMT2A (0.59) | CNR2CNR1MEN1KMT2A | |
| SCHEMBL7149101 | 0.75 | ADRB2 (0.66) | ADRB3ADRB1ADRB2OPRM1ADRA1D |
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-4117157-A | TREATMENT OF CARDIOVASCULAR DISORDERS | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1978-09-26 | — | — | US | disclosed |