Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 8/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 8/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10504268 | 0.85 | ADRB2 (0.44) | CYP2D6CYP1A2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL10593198 | 0.82 | CASR (0.51) | CYP2D6CYP1A2KDM4EADRB2ADRB1 | |
| SCHEMBL10592316 | 0.80 | ABCB1 (0.43) | CYP1A2ADRB2ADRB1ADRB3MEN1 | |
| SCHEMBL10593247 | 0.79 | HTR1A (0.57) | CYP2D6CYP1A2KDM4EADRB2ADRB1 | |
| SCHEMBL10506852 | 0.78 | ADRB2 (0.52) | CYP2D6CYP1A2KDM4EALDH1A1ADRB2 | |
| SCHEMBL12120711 | 0.78 | ADRB2 (0.67) | CYP2D6CYP1A2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL10505130 | 0.77 | HTR1A (0.55) | CYP2D6CYP1A2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL10506404 | 0.77 | CYP2D6 (0.49) | CYP2D6CYP1A2ALDH1A1HSD17B10ADRB2 | |
| SCHEMBL10504203 | 0.76 | L3MBTL1 (0.49) | KDM4EALDH1A1ADRB2ADRB1ADRB3 | |
| SCHEMBL10504556 | 0.75 | L3MBTL1 (0.39) | CYP2D6ADRB2ADRB1ADRB3GLA |
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-0200915-B1 | AMINOPROPANOL DERIVATIVES, PROCESS FOR THEIR PREPARATION, THEIR USE AND MEDICINES CONTAINING THEM | Roche Diagnostics GmbH (DE) | 1989-09-27 | — | — | EP | disclosed |
| US-4863949-A | CARDIOVASCULAR DISORDER TREATMENT | BOEHRINGER MANNHEIM GMBH (DE) | 1989-09-05 | — | — | US | disclosed |