Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 11/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 10/20 | 0.39 |
| ▸ | HTR1A | P08908 | 3/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | GRK3 | P35626 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10592480 | 0.98 | ABCB1 (0.42) | ABCB1ADRB2ADRB1HTR1ASLC6A4 | |
| SCHEMBL10505167 | 0.86 | ABCB1 (0.39) | ABCB1ADRB2ADRB1HTR1ASLC6A4 | |
| SCHEMBL10592316 | 0.84 | ABCB1 (0.43) | ABCB1ADRB2ADRB1HTR1ASLC6A4 | |
| SCHEMBL10503780 | 0.84 | ABCB1 (0.40) | ABCB1ADRB2ADRB1HTR1ASLC6A4 | |
| SCHEMBL10503951 | 0.83 | GRK3 (0.40) | ADRB2ADRB1ADRB3MEN1CYP1A2 | |
| SCHEMBL10592973 | 0.83 | CASR (0.49) | ADRB2ADRB1ADRB3LMNAMEN1 | |
| SCHEMBL10503702 | 0.83 | CYP2D6 (0.49) | ABCB1ADRB2ADRB1HTR1ASLC6A4 | |
| SCHEMBL10592879 | 0.82 | HTR1A (0.61) | ADRB2ADRB1HTR1ASLC6A4ADRB3 | |
| SCHEMBL10594698 | 0.82 | ADRB2 (0.61) | ABCB1ADRB2ADRB1HTR1ASLC6A4 | |
| SCHEMBL10595545 | 0.81 | HTR1A (0.42) | ADRB2ADRB1HTR1ASLC6A4ADRB3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4863949-A | CARDIOVASCULAR DISORDER TREATMENT | BOEHRINGER MANNHEIM GMBH (DE) | 1989-09-05 | — | — | US | disclosed |
| EP-0200915-A1 | Aminopropanol derivatives, process for their preparation, their use and medicines containing them | Roche Diagnostics GmbH (DE) | 1986-11-12 | — | — | EP | disclosed |