Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 5/20 | 0.58 |
| ▸ | ADRB3 | P13945 | 5/20 | 0.58 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 5/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.49 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.47 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | GRIN2A | Q12879 | 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 | |
|---|---|---|---|---|
| SCHEMBL11546769 | 0.90 | ADRB3 (0.51) | ADRB1ADRB3ADRB2CYP1A2ATM | |
| SCHEMBL11549703 | 0.86 | ADRB2 (0.55) | ADRB1ADRB3ADRB2CYP3A4OPRM1 | |
| SCHEMBL11545703 | 0.85 | ADRB1 (0.45) | ADRB1ADRB3ADRB2MEN1KMT2A | |
| SCHEMBL11545627 | 0.85 | KDM4E (0.53) | ADRB1ADRB3ADRB2ATMABCB1 | |
| SCHEMBL11547605 | 0.83 | OPRM1 (0.46) | ADRB1ADRB3ADRB2CYP1A2ATM | |
| SCHEMBL11549323 | 0.83 | KDM4E (0.49) | ADRB1ADRB3ADRB2ABCB1KMT2A | |
| SCHEMBL11546599 | 0.82 | ADRB2 (0.47) | ADRB1ADRB3ADRB2CYP1A2CYP3A4 | |
| SCHEMBL11549418 | 0.81 | ADRB2 (0.48) | ADRB1ADRB3ADRB2CYP1A2ATM | |
| SCHEMBL7410486 | 0.79 | ADRB2 (0.54) | ADRB1ADRB3ADRB2CYP3A4OPRM1 | |
| SCHEMBL9685167 | 0.78 | ADRB1 (0.69) | ADRB1ADRB3ADRB2MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4027027-A | BETA-RECEPTOR-BLOCKERS, HYPOTENSIVES AND VALODILATORS; FOR TREATING ARRYTHMIAS AND ANGINA PECTORIS | CIBA-GEIGY CORPORATION (US) | 1977-05-31 | — | — | US | claimed |
| US-4139623-A | HYPOTENSIVE AGENTS | C-G CORP. (US) | 1979-02-13 | — | — | US | disclosed |
| US-4027027-A | BETA-RECEPTOR-BLOCKERS, HYPOTENSIVES AND VALODILATORS; FOR TREATING ARRYTHMIAS AND ANGINA PECTORIS | CIBA-GEIGY CORPORATION (US) | 1977-05-31 | — | — | US | disclosed |