Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11247633 | 0.80 | ALDH1A1 (0.48) | AKR1B1ALDH1A1KMT2ALMNAMEN1 | |
| SCHEMBL11249016 | 0.79 | ADRA2A (0.49) | AKR1B1ALDH1A1KMT2AADRA2ALMNA | |
| SCHEMBL11040309 | 0.78 | ALDH1A1 (0.41) | AKR1B1ALDH1A1CXCL8KMT2AADRA2A | |
| SCHEMBL8830155 | 0.78 | ALDH1A1 (0.41) | AKR1B1ALDH1A1CXCL8KMT2AADRA2A | |
| SCHEMBL2838988 | 0.77 | CXCL8 (0.45) | ALDH1A1CXCL8KMT2AADRA2ALMNA | |
| SCHEMBL1922886 | 0.77 | HSP90AA1 (0.37) | ALDH1A1LMNACYP2D6CYP3A4CYP2C9 | |
| SCHEMBL6260569 | 0.77 | CXCL8 (0.53) | ALDH1A1CXCL8KMT2AADRA2ALMNA | |
| SCHEMBL11249009 | 0.76 | CYP1A2 (0.39) | AKR1B1ALDH1A1CXCL8KMT2AADRA2A | |
| Hydrochloric Acid SCHEMBL4670665 | 0.74 | ADRA2A (0.39) | AKR1B1ALDH1A1CXCL8KMT2AADRA2A | |
| SCHEMBL10952785 | 0.74 | GABRA1 (0.43) | ALDH1A1LMNAKDM4EPARP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4567264-A | ADRENERGIC BLOCKING AGENTS | SYNTEX (U.S.A.) INC. (US) | 1986-01-28 | — | — | US | disclosed |
| US-4558129-A | Benzodioxanyl-hydroxyethylene-piperazinyl acetanilides which effect calcium entry and β-blockade | SYNTEX (U.S.A.) INC. (US) | 1985-12-10 | — | — | US | disclosed |
| US-4499100-A | CARDIOUVASCULAR DISORDERS | SYNTEX (U.S.A.) INC. (US) | 1985-02-12 | — | — | US | disclosed |
| EP-0126449-A1 | Cardioselective aryloxy- and arylthio-hydroxypropyl piperazinyl acetanilides wich affect calcium entry | SYNTEX (U.S.A.) INC. (US) | 1984-11-28 | — | — | EP | disclosed |