Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL27040318 | 0.70 | CYP19A1 (0.47) | CYP19A1 | |
| SCHEMBL20805424 | 0.70 | CYP19A1 (0.47) | CYP19A1 | |
| SCHEMBL16800674 | 0.70 | HSD11B1 (0.38) | TAAR1CYP19A1HSD11B1HSD17B10 | |
| SCHEMBL4329065 | 0.69 | CYP19A1 (0.32) | CYP19A1 | |
| SCHEMBL16801035 | 0.69 | GRIN1 (0.41) | TAAR1HSD11B1 | |
| SCHEMBL19586055 | 0.64 | MMP1 (0.39) | CYP19A1HSD11B1 | |
| SCHEMBL4333448 | 0.63 | TSHR (0.34) | CYP19A1 | |
| SCHEMBL30912373 | 0.63 | GRIN1 (0.42) | CYP19A1HSD11B1HSD17B10 | |
| SCHEMBL28617264 | 0.63 | KDM1A (0.42) | — | |
| SCHEMBL16799247 | 0.63 | ALDH1A1 (0.32) | CYP19A1HSD11B1 |
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-2015083130-A1 | FUSED PYRIDINE AND PYRIMIDINE DERIVATIVES AS ROR GAMMA MODULATORS | AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) | 2015-06-11 | — | — | WO | disclosed |