Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.74 |
| ▸ | ADRB2 | P07550 | 6/20 | 0.64 |
| ▸ | ADRB1 | P08588 | 6/20 | 0.64 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.64 |
| ▸ | TSHR | P16473 | 2/20 | 0.64 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.64 |
| ▸ | NPC1 | O15118 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 1/20 | 0.64 |
| ▸ | RAB9A | P51151 | 1/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.64 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.64 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.55 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.55 |
| ▸ | HTR1A | P08908 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10876733 | 0.99 | CYP2D6 (0.72) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL10877118 | 0.86 | ADRB2 (0.70) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| Ronactolol SCHEMBL1254628 | 0.86 | ADRB2 (0.70) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL10877050 | 0.86 | KMT2A (0.70) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL11854073 | 0.86 | CYP2D6 (1.00) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| Hydrochloric Acid SCHEMBL10880309 | 0.85 | ADRB2 (0.68) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL10878014 | 0.85 | ADRB2 (0.68) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| Hydrochloric Acid SCHEMBL11040776 | 0.85 | KMT2A (0.68) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL10881343 | 0.85 | ADRB1 (0.71) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 | |
| SCHEMBL10839737 | 0.85 | CYP2D6 (0.74) | CYP2D6ADRB2ADRB1ADRB3CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0100051-B1 | NEW DERIVATIVES OF 1-ALKYLAMINE-(4(P-ALKYLOXY-BENZAMIDE)PHENOXY)-2-PROPANOL, HAVING BETA-SYMPATHOLYTIC ACTIVITY, THEIR SALTS, AND PRODUCTION PROCESSES THEREOF | A. Menarini S.a.S. (IT) | 1986-04-09 | — | — | EP | claimed |
| US-4503075-A | ADRENERGIC BLOCKING AGENTS | A. MENARINI S.A.S. (IT) | 1985-03-05 | — | — | US | claimed |
| EP-0100051-B1 | NEW DERIVATIVES OF 1-ALKYLAMINE-(4(P-ALKYLOXY-BENZAMIDE)PHENOXY)-2-PROPANOL, HAVING BETA-SYMPATHOLYTIC ACTIVITY, THEIR SALTS, AND PRODUCTION PROCESSES THEREOF | A. Menarini S.a.S. (IT) | 1986-04-09 | — | — | EP | disclosed |