Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 18/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 12/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL20285871 | 1.00 | ADRB2 (0.42) | ADRB2ADRB1KDM4EMEN1LMNA | |
| SCHEMBL20285791 | 0.84 | ADRB2 (0.48) | ADRB2ADRB1 | |
| SCHEMBL18601883 | 0.82 | ADRB2 (0.42) | ADRB2ADRB1KDM4EMEN1LMNA | |
| SCHEMBL99134 | 0.81 | ADRB2 (0.46) | ADRB2ADRB1DRD2 | |
| SCHEMBL30490482 | 0.81 | ADRB2 (0.46) | ADRB2ADRB1DRD2 | |
| SCHEMBL2568651 | 0.81 | ADRB2 (0.46) | ADRB2ADRB1DRD2 | |
| SCHEMBL11912040 | 0.80 | ADRB2 (0.46) | ADRB2ADRB1KDM4EMEN1LMNA | |
| SCHEMBL25666155 | 0.80 | ADRB2 (0.47) | ADRB2ADRB1DRD2 | |
| SCHEMBL25666134 | 0.80 | ADRB2 (0.47) | ADRB2ADRB1DRD2 | |
| SCHEMBL19386639 | 0.75 | ADRB2 (0.36) | ADRB2ADRB1KDM4EMEN1LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3556435-B1 | CLASS OF BIFUNCTIONAL COMPOUNDS WITH QUATERNARY AMMONIUM SALT STRUCTURE | BEIJING SHOWBY PHARMACEUTICAL CO LTD (CN) | 2020-10-28 | — | — | EP | disclosed |