Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 14/20 | 0.70 |
| ▸ | CASR | P41180 | 4/20 | 0.63 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10943456 | 0.86 | CYP2D6 (0.66) | CYP2D6CASRMEN1SLC22A1KMT2A | |
| SCHEMBL11496120 | 0.83 | CYP2D6 (1.00) | CYP2D6CASRMEN1SLC22A1KMT2A | |
| Oxalic Acid SCHEMBL11489521 | 0.81 | CYP2D6 (0.62) | CYP2D6CASRMEN1SLC22A1KMT2A | |
| Hydrochloric Acid SCHEMBL11488169 | 0.80 | CYP2D6 (0.78) | CYP2D6CASRMEN1SLC22A1KMT2A | |
| SCHEMBL11489571 | 0.79 | CYP2D6 (0.71) | CYP2D6CASRMEN1SLC22A1KMT2A | |
| SCHEMBL11579278 | 0.78 | CASR (0.67) | CYP2D6CASRMEN1KMT2A | |
| SCHEMBL11487276 | 0.78 | CYP2D6 (0.79) | CYP2D6CASRMEN1SLC22A1KMT2A | |
| SCHEMBL11492849 | 0.78 | CYP2D6 (0.78) | CYP2D6CASRMEN1SLC22A1KMT2A | |
| SCHEMBL11596421 | 0.78 | CASR (1.00) | CYP2D6CASRADRB3 | |
| SCHEMBL11582982 | 0.78 | CASR (0.85) | CYP2D6CASRMEN1KMT2AADRB3 |
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-4495352-A | HYPOTENSIVE AGENTS; VASODILATION; ADRENERGIC BLOCKING ACTION | MEAD JOHNSON & COMPANY (US) | 1985-01-22 | — | — | US | disclosed |
| US-4314943-A | ANTIHYPERTENSIVE AGENTS; VASODILATORS | MEAD JOHNSON & COMPANY (US) | 1982-02-09 | — | — | US | disclosed |
| US-4234595-A | HYPOTENSIVE AGENTS; ADRENERGIC BLOCKING AGENTS; VASODILATION | MEAD JOHNSON & COMPANY (US) | 1980-11-18 | — | — | US | disclosed |