Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.52 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.52 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.52 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.52 |
| ▸ | PGR | P06401 | 1/20 | 0.52 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.52 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30261823 | 0.84 | ABCC3 (0.65) | ADORA3ABCC3ABCC4ABCB11PGR | |
| SCHEMBL4956681 | 0.83 | ADORA3 (0.61) | ADORA3ABCC3ABCC4ABCB11PGR | |
| SCHEMBL8261277 | 0.83 | KMT2A (0.53) | ADORA3ABCC3ABCC4ABCB11PGR | |
| SCHEMBL4956672 | 0.83 | ADORA3 (0.61) | ADORA3ABCC3ABCC4ABCB11PGR | |
| SCHEMBL893093 | 0.82 | CYP3A4 (0.43) | ADORA3ABCC3ABCC4ABCB11PGR | |
| SCHEMBL893096 | 0.82 | CYP3A4 (0.43) | ADORA3ABCC3ABCC4ABCB11PGR | |
| SCHEMBL4961238 | 0.81 | ADORA3 (0.64) | ADORA3ABCC3ABCC4ABCB11PGR | |
| SCHEMBL8769837 | 0.79 | CTRB1 (0.48) | CYP3A4PSMB5LMNA | |
| SCHEMBL13535100 | 0.77 | MME (0.39) | CYP3A4PSMB5 | |
| SCHEMBL14599866 | 0.77 | MME (0.39) | CYP3A4PSMB5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8481571-B2 | Anti-coronavirus compounds | ACADEMIA SINICA (TW) | 2013-07-09 | — | — | US | disclosed |
| US-8481571-B2 | Anti-coronavirus compounds | ACADEMIA SINICA (TW) | 2013-07-09 | — | — | US | disclosed |
| WO-2006073456-A2 | ANTI-CORONAVIRUS COMPOUNDS | ACADEMIA SINICA (TW) | 2006-07-13 | — | — | WO | disclosed |