Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.34 |
| ▸ | CCNC | P24863 | 8/20 | 0.34 |
| ▸ | CDK8 | P49336 | 8/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21599145 | 0.90 | LMNA (0.42) | ADRB2LMNANPSR1KDM4ECYP3A4 | |
| SCHEMBL21599176 | 0.84 | LMNA (0.38) | ADRB2LMNANPSR1KDM4ECYP3A4 | |
| SCHEMBL21599203 | 0.83 | CYP3A4 (0.39) | ADRB2LMNANPSR1KDM4ECYP3A4 | |
| SCHEMBL19986733 | 0.80 | ADRB2 (0.67) | ADRB2LMNANPSR1KDM4ECYP3A4 | |
| SCHEMBL21599148 | 0.80 | BCL2A1 (0.44) | CYP3A4MAPTALDH1A3 | |
| SCHEMBL21599151 | 0.77 | CYP3A4 (0.43) | ADRB2LMNANPSR1KDM4ECYP3A4 | |
| SCHEMBL21599195 | 0.77 | ADRB2 (0.41) | ADRB2LMNANPSR1KDM4ECYP3A4 | |
| SCHEMBL21599186 | 0.77 | ADRB2 (0.50) | ADRB2LMNANPSR1KDM4ECYP3A4 | |
| SCHEMBL21599143 | 0.76 | ADRB2 (0.53) | ADRB2LMNANPSR1KDM4ECYP3A4 | |
| SCHEMBL16707783 | 0.75 | ADRB2 (0.49) | ADRB2LMNANPSR1KDM4ECYP3A4 |
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-3068774-B1 | AZEPANE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS | NOVIRA THERAPEUTICS INC (US) | 2019-12-25 | — | — | EP | disclosed |
| WO-2018050110-A1 | NOVEL CAPSID PROTEIN ASSEMBLY INHIBITOR | 正大天晴药业集团股份有限公司 | 2018-03-22 | — | — | WO | disclosed |