Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 13/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | LOX | P28300 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3126629 | 0.82 | APLNR (0.49) | CA2TBXAS1 | |
| SCHEMBL4313325 | 0.81 | CYP11B2 (0.37) | TBXAS1CYP11B2DYRK1A | |
| SCHEMBL4314286 | 0.79 | CA2 (0.38) | CA2LOX | |
| SCHEMBL3132047 | 0.78 | ALDH1A1 (0.39) | TBXAS1CYP11B2DYRK1A | |
| SCHEMBL4306556 | 0.71 | KDM4E (0.45) | DYRK1A | |
| SCHEMBL2433226 | 0.71 | HCAR2 (0.42) | TBXAS1CYP11B2DYRK1A | |
| SCHEMBL4316426 | 0.69 | PIK3CB (0.46) | CYP11B2DYRK1A | |
| SCHEMBL31368435 | 0.69 | CA2 (0.42) | CA2CYP11B2DYRK1A | |
| SCHEMBL2438139 | 0.68 | TBXAS1 (0.40) | TBXAS1 | |
| SCHEMBL2564771 | 0.67 | TNKS2 (0.38) | CA2CYP11B2LOX |
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-2009137338-A1 | PYRAZOLE COMPOUNDS AS CCR1 ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-11-12 | — | — | WO | disclosed |