Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | MPO | P05164 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18831361 | 0.83 | CYP3A4 (0.39) | CYP3A4MPOCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL20195430 | 0.82 | PSMB5 (0.36) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL22038736 | 0.80 | SLC22A12 (0.42) | CYP3A4MPOCYP2C9CYP2C19 | |
| SCHEMBL22038186 | 0.79 | HTR7 (0.42) | CYP3A4MPOCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL16437150 | 0.77 | JAK2 (0.32) | CYP3A4MPOCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL20195461 | 0.73 | CYP1A2 (0.33) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL22037256 | 0.68 | HTR7 (0.45) | CYP3A4CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL20195388 | 0.67 | HTR7 (0.35) | — | |
| SCHEMBL20195489 | 0.67 | CD38 (0.32) | CYP3A4 | |
| SCHEMBL22038773 | 0.67 | HTR7 (0.40) | — |
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-3029035-B1 | TETRAZOLINONE COMPOUND, AND USE THEREOF | SUMITOMO CHEMICAL CO (JP) | 2018-05-30 | — | — | EP | disclosed |