Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.68 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.68 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.62 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.62 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.62 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | CNR1 | P21554 | 1/20 | 0.61 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.61 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.61 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL9629561 | 0.85 | ADRB2 (0.71) | PTGS1SLC6A2ADRB2ADRB1CYP2D6 | |
| SCHEMBL9629567 | 0.85 | ADRB2 (0.71) | PTGS1SLC6A2ADRB2ADRB1CYP2D6 | |
| SCHEMBL11594190 | 0.83 | PTGS1 (0.67) | PTGS1SLC6A2ADRB2ADRB1CYP2D6 | |
| SCHEMBL11251793 | 0.82 | PTGS1 (0.65) | PTGS1SLC6A2ADRB2ADRB1CYP2D6 | |
| Hydrochloric Acid SCHEMBL11170713 | 0.81 | MAPT (0.64) | PTGS1SLC6A2ADRB2ADRB1CYP2D6 | |
| Prenalterol SCHEMBL249753 | 0.81 | PTGS1 (1.00) | PTGS1SLC6A2ADRB2ADRB1CYP2D6 | |
| Prenalterol SCHEMBL10816429 | 0.81 | PTGS1 (1.00) | PTGS1SLC6A2ADRB2ADRB1CYP2D6 | |
| Prenalterol SCHEMBL10788435 | 0.81 | PTGS1 (1.00) | PTGS1SLC6A2ADRB2ADRB1CYP2D6 | |
| SCHEMBL11591934 | 0.80 | ADRB2 (0.63) | PTGS1SLC6A2ADRB2ADRB1CYP2D6 | |
| SCHEMBL11594087 | 0.80 | ADRB2 (0.72) | PTGS1SLC6A2ADRB2ADRB1CYP2D6 |
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-4080471-A | ANTIARRYTHMIA | AKTIEBOLAGET HASSLE (SW) | 1978-03-21 | — | — | US | claimed |