Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 6/20 | 0.54 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.54 |
| ▸ | CNR1 | P21554 | 1/20 | 0.51 |
| ▸ | ADRB2 | P07550 | 11/20 | 0.51 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.48 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.48 |
| ▸ | CRHBP | P24387 | 1/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11652084 | 1.00 | ADRB3 (0.54) | ADRB3ADRB1CNR1ADRB2ASAH1 | |
| SCHEMBL11655875 | 1.00 | ADRB3 (0.54) | ADRB3ADRB1CNR1ADRB2ASAH1 | |
| Oxalic Acid SCHEMBL11655462 | 0.97 | ADRB3 (0.52) | ADRB3ADRB1CNR1ADRB2ASAH1 | |
| Oxalic Acid SCHEMBL11654026 | 0.97 | ADRB3 (0.52) | ADRB3ADRB1CNR1ADRB2ASAH1 | |
| Oxalic Acid SCHEMBL11655003 | 0.97 | ADRB3 (0.52) | ADRB3ADRB1CNR1ADRB2ASAH1 | |
| SCHEMBL11653151 | 0.91 | CNR2 (0.56) | ADRB3ADRB1CNR1ADRB2OPRM1 | |
| SCHEMBL8048083 | 0.87 | BCAT2 (0.62) | CNR1ASAH1OPRM1OPRD1CNR2 | |
| SCHEMBL11655675 | 0.80 | HPGD (0.57) | CNR1CNR2POLB | |
| SCHEMBL11570223 | 0.78 | MEN1 (0.64) | ADRB3ADRB1CNR1ADRB2 | |
| SCHEMBL11653836 | 0.78 | POLB (0.57) | ADRB3CNR1CNR2POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0000809-B1 | ANTI-INFLAMMATORY 1-PHENYLETHANOLAMINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF AND PROCESSES FOR THEIR MANUFACTURE | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1982-04-14 | — | — | EP | disclosed |
| US-4117157-A | TREATMENT OF CARDIOVASCULAR DISORDERS | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1978-09-26 | — | — | US | disclosed |