Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.37 |
| ▸ | CCR1 | P32246 | 2/20 | 0.36 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.36 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.36 |
| ▸ | TTK | P33981 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CALCA | P06881 | 1/20 | 0.35 |
| ▸ | DCTPP1 | Q9H773 | 2/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.34 |
| ▸ | SMO | Q99835 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL359611 | 0.83 | KCNH2 (0.46) | CYP2C9CYP3A4CYP2C19KCNH2POLB | |
| SCHEMBL826461 | 0.78 | CYP2C9 (0.45) | CYP2C9CYP3A4CYP2C19KCNH2CCR1 | |
| SCHEMBL826251 | 0.78 | CYP2C9 (0.54) | CYP2C9CYP3A4CYP2C19KCNH2ACE2 | |
| SCHEMBL10069921 | 0.78 | CALCA (0.41) | CYP2C9CYP3A4CYP2C19KCNH2POLB | |
| SCHEMBL368651 | 0.77 | LMNA (0.45) | CYP2C9CYP3A4CYP2C19KCNH2ACE2 | |
| SCHEMBL368831 | 0.77 | KCNH2 (0.42) | CYP2C9CYP3A4CYP2C19KCNH2POLB | |
| SCHEMBL371233 | 0.77 | LMNA (0.47) | CYP2C9CYP3A4CYP2C19KCNH2ACE2 | |
| SCHEMBL10070414 | 0.77 | CNR2 (0.39) | CYP2C9CYP3A4CYP2C19KCNH2POLB | |
| SCHEMBL369169 | 0.77 | ACE2 (0.41) | CYP2C9CYP3A4CYP2C19KCNH2ACE2 | |
| SCHEMBL359557 | 0.76 | CYP2C9 (0.43) | CYP2C9CYP3A4CYP2C19KCNH2CCR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012006680-A1 | 7, 9-NITROGEN RADICAL-4-OXO-4H-PYRIDO[L,2-A]PYRIMIDINE-2-CARBOXYLIC ACID BENZYLAMIDE ANTI-VIRALS | AVEXA LIMITED (AU) | 2012-01-19 | — | — | WO | disclosed |