Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 7/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL11097452 | 0.88 | CYP11B1 (0.55) | CYP11B1CYP11B2TBXAS1CYP19A1 | |
| SCHEMBL10646442 | 0.77 | PDE3B (0.46) | CYP11B1CYP11B2TBXAS1CYP19A1MAPK1 | |
| SCHEMBL11101902 | 0.74 | CYP3A4 (0.33) | CYP11B1CYP11B2MAPK1 | |
| SCHEMBL11103538 | 0.72 | CYP19A1 (0.54) | TBXAS1CYP19A1KMT2A | |
| SCHEMBL11101069 | 0.71 | HMOX1 (0.55) | TBXAS1CYP19A1 | |
| SCHEMBL11099534 | 0.71 | HMOX1 (0.54) | TBXAS1CYP19A1 | |
| SCHEMBL10648178 | 0.70 | PDE3B (0.44) | CYP11B1CYP11B2TBXAS1CYP19A1MAPK1 | |
| SCHEMBL10645518 | 0.70 | PDE3B (0.43) | CYP11B1CYP11B2TBXAS1MAPK1 | |
| SCHEMBL10926117 | 0.69 | PDE3B (0.42) | TBXAS1MAPK1 | |
| SCHEMBL10922175 | 0.69 | PDE3B (0.42) | TBXAS1MAPK1 |
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-0122419-A2 | Substituted 3-mercaptopyridazines, their 3-alkylthio derivatives and processes for their preparation | A. Nattermann & Cie. GmbH (DE) | 1984-10-24 | — | — | EP | disclosed |