Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | HTR1A | P08908 | 1/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.57 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6582931 | 0.83 | ADRB1 (0.63) | ADRB1ALDH1A1LMNACYP3A4HTR1A | |
| SCHEMBL6584182 | 0.82 | ADRB1 (0.58) | ADRB1ALDH1A1LMNACYP3A4HTR1A | |
| SCHEMBL7468775 | 0.82 | ADRA1D (0.64) | ADRB1ALDH1A1LMNACYP3A4HTR1A | |
| Hydrochloric Acid SCHEMBL8126599 | 0.81 | ADRA1D (0.63) | ADRB1ALDH1A1LMNACYP3A4HTR1A | |
| Ammonia Solution, Strong SCHEMBL8123524 | 0.81 | ADRA1D (0.51) | ADRB1ALDH1A1LMNACYP3A4HTR1A | |
| SCHEMBL31051847 | 0.80 | ADRB1 (0.67) | ADRB1ALDH1A1LMNACYP3A4HTR1A | |
| SCHEMBL13499602 | 0.80 | ADRB1 (0.67) | ADRB1ALDH1A1LMNACYP3A4HTR1A | |
| SCHEMBL8124793 | 0.79 | ADRA1D (0.59) | ADRB1ALDH1A1LMNACYP3A4HTR1A | |
| SCHEMBL13239004 | 0.79 | ADRB1 (0.71) | ADRB1ALDH1A1LMNACYP3A4HTR1A | |
| SCHEMBL14445528 | 0.78 | ADRB1 (0.57) | ADRB1ALDH1A1LMNACYP3A4HTR1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0717739-A1 | BICYCLIC AROMATIC COMPOUNDS AS THERAPEUTIC AGENTS | Knoll AG (DE) | 1996-06-26 | — | — | EP | disclosed |
| WO-1995007274-A1 | BICYCLIC AROMATIC COMPOUNDS AS THERAPEUTIC AGENTS | KNOLL AG (DE) | 1995-03-16 | — | — | WO | disclosed |