Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ICMT | O60725 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.36 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.36 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.36 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8501020 | 0.81 | CYP3A4 (0.53) | CYP3A4CYP2E1CYP2A6CYP1A2CYP2D6 | |
| SCHEMBL8500406 | 0.81 | RPS6KA5 (0.40) | TRPV1HSD11B1RPS6KA5 | |
| SCHEMBL12528529 | 0.79 | TRPV1 (0.41) | TRPV1CYP1A2HSD11B1RPS6KA5CYP17A1 | |
| SCHEMBL8498621 | 0.79 | RPS6KA5 (0.38) | TRPV1HSD11B1RPS6KA5 | |
| SCHEMBL12342913 | 0.76 | CYP3A4 (0.47) | CYP3A4CYP2E1CYP2A6CYP1A2CYP2D6 | |
| SCHEMBL8502061 | 0.76 | CYP3A4 (0.47) | CYP3A4CYP2E1CYP2A6CYP1A2CYP2D6 | |
| SCHEMBL8733365 | 0.76 | CYP3A4 (0.47) | CYP3A4CYP2E1CYP2A6CYP1A2CYP2D6 | |
| SCHEMBL7130873 | 0.75 | CYP2E1 (0.46) | CYP3A4CYP2E1CYP2A6HSD11B1ALDH1A1 | |
| SCHEMBL10757865 | 0.73 | CYP2E1 (0.38) | CYP3A4CYP2E1CYP2A6TRPV1ALDH1A1 | |
| SCHEMBL12528652 | 0.72 | TRPV1 (0.42) | TRPV1CYP1A2HSD11B1CYP17A1 |
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-0946559-A2 | IMIDAZOPYRIDAZINES | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 1999-10-06 | — | — | EP | disclosed |
| WO-1998028299-A2 | IMIDAZOPYRIDAZINES | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1998-07-02 | — | — | WO | disclosed |