Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ADH5 | P11766 | 3/20 | 0.36 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL11015694 | 1.00 | TBXAS1 (0.44) | TBXAS1ALDH1A1ESR1ADH5MAOB | |
| SCHEMBL8828401 | 0.81 | TBXAS1 (0.41) | TBXAS1ALDH1A1ADH5MAOBCYP3A4 | |
| SCHEMBL8828392 | 0.81 | TBXAS1 (0.41) | TBXAS1ALDH1A1ADH5MAOBCYP3A4 | |
| SCHEMBL7296206 | 0.79 | MAOB (0.57) | TBXAS1ALDH1A1ESR1ADH5MAOB | |
| SCHEMBL7296217 | 0.79 | MAOB (0.57) | TBXAS1ALDH1A1ESR1ADH5MAOB | |
| SCHEMBL10651014 | 0.77 | TBXAS1 (0.48) | TBXAS1ADH5EGLN3CYP3A4BAZ2B | |
| SCHEMBL10365507 | 0.72 | IDO1 (0.44) | ADH5CYP3A4BAZ2BKMT2AIDO1 | |
| SCHEMBL10648270 | 0.67 | TBXAS1 (0.40) | TBXAS1ALDH1A1ADH5CYP3A4BAZ2B | |
| SCHEMBL10365545 | 0.66 | CYP3A4 (0.47) | TBXAS1ALDH1A1ADH5MAOBCYP3A4 | |
| SCHEMBL11016212 | 0.66 | PDE3B (0.50) | TBXAS1ADH5CYP3A4RAB9ANPC1 |
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-0150463-A1 | Substituted 4.5-dihydro-6-vinyl-3(2H)-pyridazinones and 6-vinyl-3(2H)-pyridazinones and process for producing the same | A. Nattermann & Cie. GmbH (DE) | 1985-08-07 | — | — | EP | disclosed |